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Acetic acid, 5-(2,2-dimethyl-6-oxocyclohexylidene)-3-methyl-pent-3-enyl ester
SpectraBase Compound ID 9R0DnMpK0lc
InChI InChI=1S/C16H24O3/c1-12(9-11-19-13(2)17)7-8-14-15(18)6-5-10-16(14,3)4/h7-8H,5-6,9-11H2,1-4H3/b12-7+,14-8+
InChIKey XTKCOWLMUGKWBS-BKKXBQFWSA-N
Mol Weight 264.36 g/mol
Molecular Formula C16H24O3
Exact Mass 264.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 80gI811LgUU
Name ACETIC ACID, 5-(2,2-DIMETHYL-6-OXO-CYCLOHEXYLIDENE)-3-METHYL-PENT-3-ENYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H24O3
InChI InChI=1S/C16H24O3/c1-12(9-11-19-13(2)17)7-8-14-15(18)6-5-10-16(14,3)4/h7-8H,5-6,9-11H2,1-4H3/b12-7+,14-8+
InChIKey XTKCOWLMUGKWBS-BKKXBQFWSA-N
Molecular Weight 264.1719
SMILES C1CC(=O)\C(=C/C=C/(CCOC(C)=O)C)C(C)(C)C1
SPLASH splash10-004i-5900000000-c2cde15fa23829f17909
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany