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3-Oxabicyclo[4.1.0]heptan-2-one, 5-methyl-, (1.alpha.,5.alpha.,6.alpha.)-(.+-.)-
SpectraBase Compound ID HhS47mqijp3
InChI InChI=1S/C7H10O2/c1-4-3-9-7(8)6-2-5(4)6/h4-6H,2-3H2,1H3/t4-,5+,6+/m0/s1
InChIKey NAYZEHULEYMULP-KVQBGUIXSA-N
Mol Weight 126.15 g/mol
Molecular Formula C7H10O2
Exact Mass 126.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IEnczwM1CFe
Name 3-Oxabicyclo[4.1.0]heptan-2-one, 5-methyl-, (1.alpha.,5.alpha.,6.alpha.)-(.+-.)-
CAS Registry Number 133868-84-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H10O2
InChI InChI=1S/C7H10O2/c1-4-3-9-7(8)6-2-5(4)6/h4-6H,2-3H2,1H3/t4-,5+,6+/m0/s1
InChIKey NAYZEHULEYMULP-KVQBGUIXSA-N
Molecular Weight 126.155 g/mol
SMILES [C@@]12([C@]([C@@](C)(COC2=O)[H])([H])C1)[H]
SPLASH splash10-0159-9000000000-524b22935c0ea04beb80
Source of Spectrum C-113-4604-36
Synonyms (1R,5R,6R)-5-methyl-3-oxabicyclo[4.1.0]heptan-2-one exo-5-methyl-3-oxabicyclo[4.1.0]heptan-2-one
Wiley ID 1129944