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2-Propenoic acid, 4-methylpentyl ester

View entire compound with spectra: 2 MS (GC)

2-Propenoic acid, 4-methylpentyl ester
SpectraBase Compound ID BE8q5wsHqUS
InChI InChI=1S/C9H16O2/c1-4-9(10)11-7-5-6-8(2)3/h4,8H,1,5-7H2,2-3H3
InChIKey BDMYQVMQTKUZNB-UHFFFAOYSA-N
Mol Weight 156.22 g/mol
Molecular Formula C9H16O2
Exact Mass 156.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1MEAziiYhUx
Name 2-Propenoic acid, 4-methylpentyl ester
Alternate Name(s) 2-Propenoic acid 4-methylpentyl ester 4-Methylpentyl acrylate Acrylic acid isohexyl ester 4-Methylpentyl prop-2-enoate Isohexyl acrylate isohexyl prop-2-enoate
CAS Registry Number 103639-02-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O2
InChI InChI=1S/C9H16O2/c1-4-9(10)11-7-5-6-8(2)3/h4,8H,1,5-7H2,2-3H3
InChIKey BDMYQVMQTKUZNB-UHFFFAOYSA-N
Molecular Weight 156.225 g/mol
SMILES C(C=C)(=O)OCCCC(C)C
SPLASH splash10-0a4l-9000000000-f2c3909607c9cd41d5de
Source of Spectrum JC-360-97-0
Wiley ID 1153846