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(+)-(R)-2-(4-Methylpentyl)cyclohexanone
SpectraBase Compound ID KQdFsWKh721
InChI InChI=1S/C12H22O/c1-10(2)6-5-8-11-7-3-4-9-12(11)13/h10-11H,3-9H2,1-2H3/t11-/m1/s1
InChIKey JRDINTKRAVGSJI-LLVKDONJSA-N
Mol Weight 182.31 g/mol
Molecular Formula C12H22O
Exact Mass 182.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FlyiOr8oMEz
Name (+)-(R)-2-(4-Methylpentyl)cyclohexanone
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O
GC Oven Program Split/Splitless injector
InChI InChI=1S/C12H22O/c1-10(2)6-5-8-11-7-3-4-9-12(11)13/h10-11H,3-9H2,1-2H3/t11-/m1/s1
InChIKey JRDINTKRAVGSJI-LLVKDONJSA-N
Instrument Name Hewlett-Packard 6890-5973
Ionization Type EI
Literature Reference DOI 10.1021/np030321z
Molecular Weight 182.307 g/mol
Optical Rotation [a]D25 = +2.1 (c = 2.23, diethyl ether)
SMILES C1CC([C@](CC1)(CCCC(C)C)[H])=O
SPLASH splash10-0002-9000000000-19487e2ffc12b2e7a284
Source of Spectrum G4-67-400-R-4
Wiley ID 1881681