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5-Isopropyl-1,3-dimethyl-bicyclo[3.2.1]octan-2-one
SpectraBase Compound ID DNYJ12X99f8
InChI InChI=1S/C13H22O/c1-9(2)13-6-5-12(4,8-13)11(14)10(3)7-13/h9-10H,5-8H2,1-4H3
InChIKey JZCFBLXJYIBMPQ-UHFFFAOYSA-N
Mol Weight 194.32 g/mol
Molecular Formula C13H22O
Exact Mass 194.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 70CTm1st06P
Name 5-Isopropyl-1,3-dimethyl-bicyclo[3.2.1]octan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O
InChI InChI=1S/C13H22O/c1-9(2)13-6-5-12(4,8-13)11(14)10(3)7-13/h9-10H,5-8H2,1-4H3
InChIKey JZCFBLXJYIBMPQ-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 194.318 g/mol
SMILES C1CC2(CC(C(C1(C)C2)=O)C)C(C)C
SPLASH splash10-0uec-8900000000-50459827c95f0b19084a
Sample Comments Major
Source of Spectrum US7691802B2
Wiley ID 1842533