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NFLGAXVYCFJBMK-RKDXNWHRSA-N
SpectraBase Compound ID K2yKXQ6Nhvw
InChI InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-9H,4-6H2,1-3H3/t8-,9-/m1/s1
InChIKey NFLGAXVYCFJBMK-RKDXNWHRSA-N
Mol Weight 154.25 g/mol
Molecular Formula C10H18O
Exact Mass 154.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9vtPvKH31bv
Name (2R,5R)-2-isopropyl-5-methyl-cyclohexanone
CAS Registry Number 491-07-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O
InChI InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-9H,4-6H2,1-3H3/t8-,9-/m1/s1
InChIKey NFLGAXVYCFJBMK-RKDXNWHRSA-N
Molecular Weight 154.253 g/mol
SMILES C1([C@](CC[C@](C1)(C)[H])(C(C)C)[H])=O
SPLASH splash10-03xr-9700000000-717129888c3f32ded4cc
Source of Spectrum SO-0-54-3
Synonyms (2R,5R)-5-methyl-2-propan-2-yl-1-cyclohexanone (2R,5R)-5-methyl-2-propan-2-yl-cyclohexan-1-one
Wiley ID 864095