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2-isopropylidene-5-methyl-hex-4-enoic acid ethyl ester
SpectraBase Compound ID BBS5R3qMPkJ
InChI InChI=1S/C12H20O2/c1-6-14-12(13)11(10(4)5)8-7-9(2)3/h7H,6,8H2,1-5H3
InChIKey FEMWKHDCWVIQMS-UHFFFAOYSA-N
Mol Weight 196.29 g/mol
Molecular Formula C12H20O2
Exact Mass 196.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2TiLrhdsoGj
Name 2-isopropylidene-5-methyl-hex-4-enoic acid ethyl ester
Alternate Name(s) 5-Methyl-2-propan-2-ylidene-4-hexenoic acid ethyl ester Ethyl 2-isopropylidene-5-methyl-hex-4-enoate Ethyl 5-methyl-2-propan-2-ylidene-hex-4-enoate
CAS Registry Number 3304-29-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O2
InChI InChI=1S/C12H20O2/c1-6-14-12(13)11(10(4)5)8-7-9(2)3/h7H,6,8H2,1-5H3
InChIKey FEMWKHDCWVIQMS-UHFFFAOYSA-N
Molecular Weight 196.290 g/mol
SMILES C(C(=O)OCC)(CC=C(C)C)=C(C)C
SPLASH splash10-0a4j-3900000000-52cf1ca0c2bbb7bbca08
Source of Spectrum F-50-13694-6
Wiley ID 790293