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(1R*, 3S*)-5,5-Dimethyl-6-(3'-oxo-1'-butenyl)-spiro[cyclohexane-1',2'-oxirane]-2-ol
SpectraBase Compound ID 2yqBkA73xNp
InChI InChI=1S/C13H20O3/c1-9(14)4-5-10-12(2,3)7-6-11(15)13(10)8-16-13/h4-5,10-11,15H,6-8H2,1-3H3/b5-4+/t10?,11?,13-/m0/s1
InChIKey VKUXHWVUTMEKGB-UFBPIKLWSA-N
Mol Weight 224.3 g/mol
Molecular Formula C13H20O3
Exact Mass 224.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hx9Ah6ZdDhr
Name (1R*, 3S*)-5,5-Dimethyl-6-(3'-oxo-1'-butenyl)-spiro[cyclohexane-1',2'-oxirane]-2-ol
Alternate Name(s) (3E)-4-[(3R)-8-hydroxy-5,5-dimethyl-1-oxaspiro[2.5]oct-4-yl]-3-buten-2-one
CAS Registry Number 137669-38-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-9(14)4-5-10-12(2,3)7-6-11(15)13(10)8-16-13/h4-5,10-11,15H,6-8H2,1-3H3/b5-4+/t10?,11?,13-/m0/s1
InChIKey VKUXHWVUTMEKGB-UFBPIKLWSA-N
Molecular Weight 224.300 g/mol
SMILES OC1[C@@]2(OC2)C(\C=C\C(=O)C)C(C)(C)CC1
SPLASH splash10-0006-9300000000-46dcea00bf6b665d0dfe
Source of Spectrum U-1992-196-8
Wiley ID 763909