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3-Octenoic acid, 2-(1-methylethylidene)-, ethyl ester, (E)-
SpectraBase Compound ID 7uG9dbG5Bq5
InChI InChI=1S/C13H22O2/c1-5-7-8-9-10-12(11(3)4)13(14)15-6-2/h9-10H,5-8H2,1-4H3/b10-9+
InChIKey UZDQATMVXYEUAB-MDZDMXLPSA-N
Mol Weight 210.32 g/mol
Molecular Formula C13H22O2
Exact Mass 210.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6vreerOdkSq
Name 3-Octenoic acid, 2-(1-methylethylidene)-, ethyl ester, (E)-
Alternate Name(s) 1,1-Dimethyl-2-(2'-butylethenyl)-2-ethoxycarbonyl-ethene Ethyl (3E)-2-(1-methylethylidene)-3-octenoate
CAS Registry Number 112151-73-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O2
InChI InChI=1S/C13H22O2/c1-5-7-8-9-10-12(11(3)4)13(14)15-6-2/h9-10H,5-8H2,1-4H3/b10-9+
InChIKey UZDQATMVXYEUAB-MDZDMXLPSA-N
Molecular Weight 210.317 g/mol
SMILES C(C(=O)OCC)(=C(C)C)\C=C\CCCC
SPLASH splash10-03ed-9030000000-662fd8050de1603adb26
Source of Spectrum J-53-609-6
Wiley ID 1209631