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(3Z)-3-(2,2-Dimethyl-6-methylenecyclohexylidene)-1-methylbutyl acetate
SpectraBase Compound ID 49j39ApberF
InChI InChI=1S/C16H26O2/c1-11-8-7-9-16(5,6)15(11)12(2)10-13(3)18-14(4)17/h13H,1,7-10H2,2-6H3/b15-12+
InChIKey PYCFMMQNMYYCKK-NTCAYCPXSA-N
Mol Weight 250.38 g/mol
Molecular Formula C16H26O2
Exact Mass 250.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4zopPMLj5Bq
Name (3Z)-3-(2,2-Dimethyl-6-methylenecyclohexylidene)-1-methylbutyl acetate
CAS Registry Number 125257-76-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26O2
InChI InChI=1S/C16H26O2/c1-11-8-7-9-16(5,6)15(11)12(2)10-13(3)18-14(4)17/h13H,1,7-10H2,2-6H3/b15-12+
InChIKey PYCFMMQNMYYCKK-NTCAYCPXSA-N
Molecular Weight 250.382 g/mol
SMILES C1CCC(\C(C1=C)=C/(C)CC(C)OC(C)=O)(C)C
SPLASH splash10-004l-3900000000-7acbba5bde2b1f936025
Source of Spectrum H-72-939-0
Synonyms Acetic acid, 3-(2,2-dimethyl-6-methylene-cyclohexylidene)-1-methyl-butyl ester Acetic acid [(4Z)-4-(2,2-dimethyl-6-methylenecyclohexylidene)pentan-2-yl] ester [(4Z)-4-(2,2-dimethyl-6-methylidenecyclohexylidene)pentan-2-yl] acetate [(3Z)-3-(2,2-dimethyl-6-methylene-cyclohexylidene)-1-methyl-butyl] acetate [(4Z)-4-(2,2-dimethyl-6-methylidene-cyclohexylidene)pentan-2-yl] ethanoate
Wiley ID 1253929