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2-Butanone, 3-(3-hydroxycyclopentyl)-3-methyl-, cis-(.+-.)-
SpectraBase Compound ID 6MS4ce5QomS
InChI InChI=1S/C10H18O2/c1-7(11)10(2,3)8-4-5-9(12)6-8/h8-9,12H,4-6H2,1-3H3/t8-,9+/m1/s1
InChIKey JPOROIXMXUHEQP-BDAKNGLRSA-N
Mol Weight 170.25 g/mol
Molecular Formula C10H18O2
Exact Mass 170.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Oi2gtTOnch
Name 2-Butanone, 3-(3-hydroxycyclopentyl)-3-methyl-, cis-(.+-.)-
Alternate Name(s) 3-[(1R,3S)-3-hydroxycyclopentyl]-3-methyl-2-butanone cis-3-(3-hydroxycyclopentyl)-3-methyl-2-butanone
CAS Registry Number 122427-35-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O2
InChI InChI=1S/C10H18O2/c1-7(11)10(2,3)8-4-5-9(12)6-8/h8-9,12H,4-6H2,1-3H3/t8-,9+/m1/s1
InChIKey JPOROIXMXUHEQP-BDAKNGLRSA-N
Molecular Weight 170.252 g/mol
SMILES O[C@@]1(C[C@](C(C(=O)C)(C)C)(CC1)[H])[H]
SPLASH splash10-0aou-9400000000-5ced064373971225a0ca
Source of Spectrum I-68-808-12
Wiley ID 1167202