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(1.alpha.,2.beta.,6.alpha.)-1-(2-Hydroxybicyclo[4.1.0]hept-2-yl)-3,3-dimethyl-2-butanone
SpectraBase Compound ID 1cKPMfOtBVr
InChI InChI=1S/C13H22O2/c1-12(2,3)11(14)8-13(15)6-4-5-9-7-10(9)13/h9-10,15H,4-8H2,1-3H3/t9-,10+,13-/m0/s1
InChIKey BJWPPHQEIUSDRF-CWSCBRNRSA-N
Mol Weight 210.32 g/mol
Molecular Formula C13H22O2
Exact Mass 210.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AZG08Zas2CD
Name (1.alpha.,2.beta.,6.alpha.)-1-(2-Hydroxybicyclo[4.1.0]hept-2-yl)-3,3-dimethyl-2-butanone
Alternate Name(s) 1-[(1R,2S,6S)-2-hydroxybicyclo[4.1.0]hept-2-yl]-3,3-dimethyl-2-butanone
CAS Registry Number 59671-47-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O2
InChI InChI=1S/C13H22O2/c1-12(2,3)11(14)8-13(15)6-4-5-9-7-10(9)13/h9-10,15H,4-8H2,1-3H3/t9-,10+,13-/m0/s1
InChIKey BJWPPHQEIUSDRF-CWSCBRNRSA-N
Molecular Weight 210.317 g/mol
SMILES O[C@]1([C@@]2(C[C@@]2(CCC1)[H])[H])CC(C(C)(C)C)=O
SPLASH splash10-0a4l-9000000000-d5251d8814472fcbe14a
Source of Spectrum J-41-3080-0
Wiley ID 1209546