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2,6-Heptadienoic acid, 5,5,6-trimethyl-4-methylene-, methyl ester
SpectraBase Compound ID LqhIiGdlQhu
InChI InChI=1S/C12H18O2/c1-9(2)12(4,5)10(3)7-8-11(13)14-6/h7-8H,1,3H2,2,4-6H3/b8-7+
InChIKey LHLXZPGARWGIOH-BQYQJAHWSA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D9KBjElh7FF
Name 2,6-Heptadienoic acid, 5,5,6-trimethyl-4-methylene-, methyl ester
CAS Registry Number 87753-88-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-9(2)12(4,5)10(3)7-8-11(13)14-6/h7-8H,1,3H2,2,4-6H3/b8-7+
InChIKey LHLXZPGARWGIOH-BQYQJAHWSA-N
Molecular Weight 194.274 g/mol
SMILES C(C(\C=C\C(=O)OC)=C)(C(=C)C)(C)C
SPLASH splash10-0aou-6900000000-398360f627d0c5f90837
Source of Spectrum K-116-2929-0
Synonyms Methyl (2E)-5,5,6-trimethyl-4-methylene-2,6-heptadienoate Methylester of 5,5,6-trimethyl-4-methylen-2,6-heptadienoic acid
Wiley ID 1190902