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2-(1-Methylpropyl)-5-methylcyclohexanone
SpectraBase Compound ID BuMAQnwEOFt
InChI InChI=1S/C11H20O/c1-4-9(3)10-6-5-8(2)7-11(10)12/h8-10H,4-7H2,1-3H3
InChIKey QSIZXATVXZYPKI-UHFFFAOYSA-N
Mol Weight 168.28 g/mol
Molecular Formula C11H20O
Exact Mass 168.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LFMBPRjAp0W
Name 2-(1-Methylpropyl)-5-methylcyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20O
InChI InChI=1S/C11H20O/c1-4-9(3)10-6-5-8(2)7-11(10)12/h8-10H,4-7H2,1-3H3
InChIKey QSIZXATVXZYPKI-UHFFFAOYSA-N
Molecular Weight 168.280 g/mol
SMILES C1(C(CCC(C1)C)C(CC)C)=O
SPLASH splash10-03di-4900000000-6f33909d710c56522901
Source of Spectrum I-69-1103-9
Synonyms 2-sec-butyl-5-methylcyclohexanone
Wiley ID 1165282