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phenethyl butyrate English (Q10864412)

Item Discussion
chemical compound
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Language Label Description Also known as
British English
No label defined
chemical compound

    Statements

    ChemSpider ID
    7375
    1 reference
    stated in
    ChemSpider
    ChemSpider ID
    7375
    language of work or name
    English
    title
    Phenethyl butyrate (English)
    retrieved
    9 October 2016
    PubChem CID
    7658
    1 reference
    stated in
    Q278487 (Deleted Item)
    PubChem CID
    7658
    language of work or name
    English
    title
    2-Phenylethyl butanoate (English)
    retrieved
    9 October 2016
    CAS registry number
    103-52-6
    2 references
    stated in
    Q902623 (Deleted Item)
    ChEBI ID
    87413
    language of work or name
    English
    title
    phenethyl butyrate (English)
    retrieved
    9 October 2016
    InChIKey
    WFNDDSQUKATKNX-UHFFFAOYSA-N
    stated in
    Q18907859 (Deleted Item)
    retrieved
    9 April 2021
    reference URL
    https://commonchemistry.cas.org/detail?cas_rn=103-52-6
    InChIKey
    WFNDDSQUKATKNX-UHFFFAOYSA-N
    2 references
    stated in
    Q278487 (Deleted Item)
    PubChem CID
    7658
    language of work or name
    English
    title
    2-Phenylethyl butanoate (English)
    retrieved
    9 October 2016
    stated in
    Q98915402 (Deleted Item)
    UNII English
    02E08ZN98R
    1 reference
    stated in
    Unique Ingredient Identifier English
    UNII English
    02E08ZN98R
    language of work or name
    English
    title
    PHENETHYL BUTYRATE (English)
    retrieved
    9 October 2016
    InChI
    InChI=1S/C12H16O2/c1-2-6-12(13)14-10-9-11-7-4-3-5-8-11/h3-5,7-8H,2,6,9-10H2,1H3
    1 reference
    stated in
    Q278487 (Deleted Item)
    PubChem CID
    7658
    language of work or name
    English
    title
    2-Phenylethyl butanoate (English)
    retrieved
    9 October 2016
    SMILES
    CCCC(=O)OCCC1=CC=CC=C1
    1 reference
    stated in
    Q278487 (Deleted Item)
    PubChem CID
    7658
    language of work or name
    English
    title
    2-Phenylethyl butanoate (English)
    retrieved
    9 October 2016
    EC number
    203-119-8
    1 reference
    stated in
    Unique Ingredient Identifier English
    UNII English
    02E08ZN98R
    language of work or name
    English
    title
    PHENETHYL BUTYRATE (English)
    retrieved
    9 October 2016
    chemical formula
    C₁₂H₁₆O₂
    1 reference
    stated in
    Q278487 (Deleted Item)
    PubChem CID
    7658
    language of work or name
    English
    title
    2-Phenylethyl butanoate (English)
    retrieved
    9 October 2016
    ChEBI ID
    87413
    mapping relation type English
    exact match English
    1 reference
    stated in
    Q902623 (Deleted Item)
    ChEBI ID
    87413
    language of work or name
    English
    title
    phenethyl butyrate (English)
    retrieved
    9 October 2016
    ChEMBL ID
    CHEMBL3187974
    1 reference
    stated in
    ChEMBL English
    ChEMBL ID
    CHEMBL3187974
    language of work or name
    English
    title
    CHEMBL3187974 (English)
    retrieved
    9 October 2016
    ECHA InfoCard ID
    100.002.836
    1 reference
    stated in
    Q59911453 (Deleted Item)
    ECHA InfoCard ID
    100.002.836
    retrieved
    27 December 2018
    title
    Phenethyl butyrate (English)
    quotation
    CAS no.: 103-52-6 (English)
    Reaxys registry number English
    1955788
    1 reference
    stated in
    Q902623 (Deleted Item)
    ChEBI ID
    87413
    language of work or name
    English
    title
    phenethyl butyrate (English)
    retrieved
    9 October 2016
    mass
    192.115±0 http://www.wikidata.org/entity/Q483261
    1 reference
    stated in
    Q278487 (Deleted Item)
    PubChem CID
    7658
    language of work or name
    English
    title
    2-Phenylethyl butanoate (English)
    retrieved
    9 October 2016
    DSSTox substance ID English
    DTXSID6047604
    1 reference
    stated in
    Q28061352 (Deleted Item)
    SPLASH English
    splash10-0udi-8900000000-8538af1bf42be4bf1d8e
    0 references
    Human Metabolome Database ID English
    HMDB0035014
    0 references
    MassBank accession ID English
    JP006417
    0 references
    CosIng number English
    40596
    1 reference
    stated in
    Q26255597 (Deleted Item)
    CosIng number English
    40596
    retrieved
    28 December 2019
    title
    PHENETHYL BUTYRATE (English)
    quotation
    CAS no.: 103-52-6 (English)
    NSC number English
    1271
    0 references
    406207
    0 references
    AICS Chemical ID
    2487
    0 references
    DSSTOX compound identifier English
    DTXCID4027604
    0 references
    FL number English
    09.168
    1 reference
    quotation
    CAS no.: 103-52-6 (English)
    stated in
    Q105044213 (Deleted Item)
    retrieved
    23 Ocak 2021
    FL number English
    09.168
    Google Knowledge Graph identifier
    /g/155sjf12
    0 references
    JECFA number English
    991
    1 reference
    stated in
    Q47128405 (Deleted Item)
    retrieved
    13 Mayıs 2021
    P11199 (Deleted Property)
    PD096035 Property P11199 not found, cannot determine the data type to use.
    0 references
    found in taxon
    Mangifera indica
    1 reference
    stated in
    Q46380420 (Deleted Item)
     
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