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(E)-3-methyl-3-pentenoic acid methyl ester
SpectraBase Compound ID VDI8iN16ub
InChI InChI=1S/C7H12O2/c1-4-6(2)5-7(8)9-3/h4H,5H2,1-3H3/b6-4+
InChIKey OUARJKDCCMXOEF-GQCTYLIASA-N
Mol Weight 128.17 g/mol
Molecular Formula C7H12O2
Exact Mass 128.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5GVNXTLVe6y
Name (E)-3-methyl-3-pentenoic acid methyl ester
Alternate Name(s) (E)-3-methylpent-3-enoic acid methyl ester Methyl (E)-3-methylpent-3-enoate Methyl 3-methyl-3-pentenoate
CAS Registry Number 2258-58-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O2
InChI InChI=1S/C7H12O2/c1-4-6(2)5-7(8)9-3/h4H,5H2,1-3H3/b6-4+
InChIKey OUARJKDCCMXOEF-GQCTYLIASA-N
Molecular Weight 128.171 g/mol
SMILES C\C(=C/C)CC(=O)OC
SPLASH splash10-00kf-9000000000-d75eb4982dc47d24d264
Wiley ID 1500319