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(+)-(3R)-2,2,3-Trimethylcyclohexanone
SpectraBase Compound ID 3TDElbI8OPx
InChI InChI=1S/C9H16O/c1-7-5-4-6-8(10)9(7,2)3/h7H,4-6H2,1-3H3/t7-/m1/s1
InChIKey XPZBNIUWMDJFPW-SSDOTTSWSA-N
Mol Weight 140.23 g/mol
Molecular Formula C9H16O
Exact Mass 140.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4vri4AEeoBk
Name (+)-(3R)-2,2,3-Trimethylcyclohexanone
Alternate Name(s) (3R)-2,2,3-trimethylcyclohexanone
CAS Registry Number 97551-89-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O
InChI InChI=1S/C9H16O/c1-7-5-4-6-8(10)9(7,2)3/h7H,4-6H2,1-3H3/t7-/m1/s1
InChIKey XPZBNIUWMDJFPW-SSDOTTSWSA-N
Molecular Weight 140.226 g/mol
SMILES C1(C(=O)CCC[C@]1(C)[H])(C)C
SPLASH splash10-05mn-9000000000-05081678613f5a3991f3
Source of Spectrum J-50-4180-17
Wiley ID 1139767