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Benzyl 3-methylbut-2-enoate
SpectraBase Compound ID 1PiG091y3lM
InChI InChI=1S/C12H14O2/c1-10(2)8-12(13)14-9-11-6-4-3-5-7-11/h3-8H,9H2,1-2H3
InChIKey WRUBNJSGJHOHJF-UHFFFAOYSA-N
Mol Weight 190.24 g/mol
Molecular Formula C12H14O2
Exact Mass 190.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FEoVbaMyTe6
Name Benzyl 3-methylbut-2-enoate
Alternate Name(s) (phenylmethyl) 3-methylbut-2-enoate 2-Butenoic acid, 3-methyl-, phenylmethyl ester 3-methyl-2-butenoic acid (phenylmethyl) ester 3-Methyl-2-butenoic acid, benzyl ester 3-methylbut-2-enoic acid benzyl ester Benzyl 3-methyl-2-butenoate Benzyl 3-methylcrotonate
CAS Registry Number 37526-89-9
Comments Less than 3 mono-isotopic peaks
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Formula C12H14O2
InChI InChI=1S/C12H14O2/c1-10(2)8-12(13)14-9-11-6-4-3-5-7-11/h3-8H,9H2,1-2H3
InChIKey WRUBNJSGJHOHJF-UHFFFAOYSA-N
Molecular Weight 190.242 g/mol
SMILES C(C=C(C)C)(=O)OCc1ccccc1
SPLASH splash10-0006-9000000000-125d1a4e6275e73735f4
Source of Spectrum KC-0-1251-6
Wiley ID 825030