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4a,7-Ethano-4aH-benzocyclohepten-5(2H)-one, 1,3,4,6,7,8-hexahydro-1,1,7-trimethyl-, (.+-.)-
SpectraBase Compound ID 2QhsNRQUClr
InChI InChI=1S/C16H24O/c1-14(2)6-4-7-16-10-9-15(3,11-13(16)17)8-5-12(14)16/h5H,4,6-11H2,1-3H3
InChIKey HILHAGRHDMVGJW-UHFFFAOYSA-N
Mol Weight 232.37 g/mol
Molecular Formula C16H24O
Exact Mass 232.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GQhy8oM5wL6
Name 4a,7-Ethano-4aH-benzocyclohepten-5(2H)-one, 1,3,4,6,7,8-hexahydro-1,1,7-trimethyl-, (.+-.)-
Alternate Name(s) 5,5,9-trimethyltricyclo[7.2.2.0(1,6)]tridec-6-en-11-one 5,9,9-Trimethyltricyclo[7.2.2.0(1,6)]]trideca-6-en-11-one
CAS Registry Number 107291-68-9
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H24O
InChI InChI=1S/C16H24O/c1-14(2)6-4-7-16-10-9-15(3,11-13(16)17)8-5-12(14)16/h5H,4,6-11H2,1-3H3
InChIKey HILHAGRHDMVGJW-UHFFFAOYSA-N
Molecular Weight 232.367 g/mol
SMILES C1=2C3(C(CC(CC2)(C)CC3)=O)CCCC1(C)C
SPLASH splash10-0159-0090000000-78a82018ddf25798fa54
Source of Spectrum F-43-5618-40
Wiley ID 1234399