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Phenethyl 2-methylbutyrate
SpectraBase Compound ID I0vdCzPQhzV
InChI InChI=1S/C13H18O2/c1-3-11(2)13(14)15-10-9-12-7-5-4-6-8-12/h4-8,11H,3,9-10H2,1-2H3
InChIKey KVKKTLBBYFABAZ-UHFFFAOYSA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2rZ8NGsAH4b
Name 2-Methylbutyric acid phenethyl ester
CAS Registry Number 24817-51-4
Comments Structure changed after expert review
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Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-3-11(2)13(14)15-10-9-12-7-5-4-6-8-12/h4-8,11H,3,9-10H2,1-2H3
InChIKey KVKKTLBBYFABAZ-UHFFFAOYSA-N
Molecular Weight 206.285 g/mol
SMILES c1c(cccc1)CCOC(=O)C(C)CC
SPLASH splash10-0pb9-7900000000-e8818a7073aae9036d3b
Source of Spectrum LQ-1992-1540-0
Synonyms 2-Phenylethyl 2-methylbutanoate Butanoic acid, 2-methyl-, 2-phenylethyl ester Phenethyl 2-methylbutyrate 2-Phenylethyl 2-methylbutyrate Phenethyl 2-methylbutanoate Phenylethyl 2-methylbutanoate .beta.-Phenethyl .alpha.-methylbutanoate Butyric acid, 2-methyl-, phenethyl ester FEMA 3632
Wiley ID 1204617