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4-Hexenoic acid, 3-methyl-, methyl ester
SpectraBase Compound ID 9GuglA4iUAO
InChI InChI=1S/C8H14O2/c1-4-5-7(2)6-8(9)10-3/h4-5,7H,6H2,1-3H3/b5-4+
InChIKey KEMAFHCORYMLRQ-SNAWJCMRSA-N
Mol Weight 142.2 g/mol
Molecular Formula C8H14O2
Exact Mass 142.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FAs2nbVw3ji
Name 4-Hexenoic acid, 3-methyl-, methyl ester
Alternate Name(s) Methyl (4E)-3-methyl-4-hexenoate (E)-3-methyl-4-hexenoic acid methyl ester (E)-3-methylhex-4-enoic acid methyl ester Methyl (E)-3-methylhex-4-enoate Methyl-3-methyl-4-hexenoate (E)-methyl 3-methylhex-4-enoate
CAS Registry Number 54004-27-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O2
InChI InChI=1S/C8H14O2/c1-4-5-7(2)6-8(9)10-3/h4-5,7H,6H2,1-3H3/b5-4+
InChIKey KEMAFHCORYMLRQ-SNAWJCMRSA-N
Molecular Weight 142.198 g/mol
SMILES C(CC(\C=C\C)C)(=O)OC
SPLASH splash10-00l6-9000000000-71272903550a39d8332a
Source of Spectrum JX-2015-6-880
Wiley ID 1727908