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(E)-Methyl 4-ethylhex-2-enoate
SpectraBase Compound ID IIKlp7eEHDC
InChI InChI=1S/C9H16O2/c1-4-8(5-2)6-7-9(10)11-3/h6-8H,4-5H2,1-3H3/b7-6+
InChIKey PSLBMXPGZSDWAI-VOTSOKGWSA-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 HMiipOOzvG0
Name (E)-Methyl 4-ethylhex-2-enoate
Alternate Name(s) (E)-4-ethyl-2-hexenoic acid methyl ester Methyl (E)-4-ethylhex-2-enoate
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Formula C9H16O2
InChI InChI=1S/C9H16O2/c1-4-8(5-2)6-7-9(10)11-3/h6-8H,4-5H2,1-3H3/b7-6+
InChIKey PSLBMXPGZSDWAI-VOTSOKGWSA-N
Literature Reference DOI 10.1021/ol102559f
Molecular Weight 156.225 g/mol
SMILES C(\C=C\C(=O)OC)(CC)CC
SPLASH splash10-0a4i-9800000000-7a10741001f5af13014a
Source of Spectrum A1-13-70/SMS20-7c
Wiley ID 1749787