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(4R,5S)-2-methyl-4-oxidanyl-5-propan-2-yl-cyclohex-2-en-1-one
SpectraBase Compound ID 5sCSCw3RJtK
InChI InChI=1S/C10H16O2/c1-6(2)8-5-9(11)7(3)4-10(8)12/h4,6,8,10,12H,5H2,1-3H3/t8-,10-/m0/s1
InChIKey ZFUJCNJIGDBFEP-WPRPVWTQSA-N
Mol Weight 168.24 g/mol
Molecular Formula C10H16O2
Exact Mass 168.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 41s4nZtkOw6
Name (4R,5S)-2-methyl-4-oxidanyl-5-propan-2-yl-cyclohex-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O2
InChI InChI=1S/C10H16O2/c1-6(2)8-5-9(11)7(3)4-10(8)12/h4,6,8,10,12H,5H2,1-3H3/t8-,10-/m0/s1
InChIKey ZFUJCNJIGDBFEP-WPRPVWTQSA-N
Molecular Weight 168.236 g/mol
SMILES O[C@@]1([C@@](CC(C(=C1)C)=O)(C(C)C)[H])[H]
SPLASH splash10-00mk-9600000000-3cb64421d31bb176f007
Source of Spectrum LQ-1992-4371-0
Synonyms (4R,5S)-4-hydroxy-2-methyl-5-propan-2-yl-1-cyclohex-2-enone (4R,5S)-4-hydroxy-2-methyl-5-propan-2-ylcyclohex-2-en-1-one (4R,5S)-4-hydroxy-5-isopropyl-2-methyl-cyclohex-2-en-1-one
Wiley ID 1164794