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CIS-2-CHLORO-3-(1-METHYLETHYL)-CYCLOHEXANONE
SpectraBase Compound ID 2Er8uKfRK14
InChI InChI=1S/C9H15ClO/c1-6(2)7-4-3-5-8(11)9(7)10/h6-7,9H,3-5H2,1-2H3/t7-,9+/m0/s1
InChIKey SPCZTZHLSCHUMW-IONNQARKSA-N
Mol Weight 174.67 g/mol
Molecular Formula C9H15ClO
Exact Mass 174.081143 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DgHhjOkxYsu
Name (2R,3S)-2-chloranyl-3-propan-2-yl-cyclohexan-1-one
Alternate Name(s) (2R,3S)-2-chloro-3-isopropyl-cyclohexanone (2R,3S)-2-chloro-3-propan-2-yl-1-cyclohexanone (2R,3S)-2-chloro-3-propan-2-ylcyclohexan-1-one
CAS Registry Number 126754-26-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H15ClO
InChI InChI=1S/C9H15ClO/c1-6(2)7-4-3-5-8(11)9(7)10/h6-7,9H,3-5H2,1-2H3/t7-,9+/m0/s1
InChIKey SPCZTZHLSCHUMW-IONNQARKSA-N
Molecular Weight 174.671 g/mol
SMILES [C@@]1([C@](C(C)C)(CCCC1=O)[H])(Cl)[H]
SPLASH splash10-001j-9700000000-7aaaa7581e0ca8c3efcd
Source of Spectrum C-112-3472-0
Wiley ID 1170502