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2H-Benzocyclohepten-2-one, 3,4,4a,5,6,7,8,9-octahydro-4a,8,8-trimethyl-
SpectraBase Compound ID 70JXGJA4Wnb
InChI InChI=1S/C14H22O/c1-13(2)6-4-7-14(3)8-5-12(15)9-11(14)10-13/h9H,4-8,10H2,1-3H3
InChIKey BODUULMIRHWXOR-UHFFFAOYSA-N
Mol Weight 206.33 g/mol
Molecular Formula C14H22O
Exact Mass 206.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KFeObPfRLlD
Name 2H-Benzocyclohepten-2-one, 3,4,4a,5,6,7,8,9-octahydro-4a,8,8-trimethyl-
Alternate Name(s) 1,5,5-Trimethyl-bicyclo(5.4.0)undec-7-en-9-one 4a,8,8-trimethyl-3,4,4a,5,6,7,8,9-octahydro-2H-benzo[a]cyclohepten-2-one
CAS Registry Number 61187-92-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O
InChI InChI=1S/C14H22O/c1-13(2)6-4-7-14(3)8-5-12(15)9-11(14)10-13/h9H,4-8,10H2,1-3H3
InChIKey BODUULMIRHWXOR-UHFFFAOYSA-N
Molecular Weight 206.329 g/mol
SMILES C1=2C(CCC(C2)=O)(CCCC(C1)(C)C)C
SPLASH splash10-05fu-9600000000-f530a68d7444979502b5
Source of Spectrum F-32-1421-0
Wiley ID 1205085