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Hex-1-en-3-yl benzoate

View entire compound with spectra: 1 MS (GC)

Hex-1-en-3-yl benzoate
SpectraBase Compound ID GmC7aTdng83
InChI InChI=1S/C13H16O2/c1-3-8-12(4-2)15-13(14)11-9-6-5-7-10-11/h4-7,9-10,12H,2-3,8H2,1H3
InChIKey PWEVLLZPVANVOL-UHFFFAOYSA-N
Mol Weight 204.27 g/mol
Molecular Formula C13H16O2
Exact Mass 204.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5tZQ4dwISNf
Name Hex-1-en-3-yl benzoate
Alternate Name(s) Benzoic acid hex-1-en-3-yl ester 1-Vinylbutyl benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O2
InChI InChI=1S/C13H16O2/c1-3-8-12(4-2)15-13(14)11-9-6-5-7-10-11/h4-7,9-10,12H,2-3,8H2,1H3
InChIKey PWEVLLZPVANVOL-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol301563g
Molecular Weight 204.269 g/mol
SMILES c1(ccccc1)C(OC(CCC)C=C)=O
SPLASH splash10-0a4i-4900000000-ea5f78f05ce01f98886b
Source of Spectrum A1-14-3716/SMS11-3t
Wiley ID 1750380