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6H-2,5a-Epoxy-1-benzoxepin-4-ol, octahydro-2-methyl-, (2.alpha.,4.beta.,5a.alpha.,9a.beta.)-
SpectraBase Compound ID JGgcTdSBJpi
InChI InChI=1S/C11H18O3/c1-10-6-8(12)7-11(14-10)5-3-2-4-9(11)13-10/h8-9,12H,2-7H2,1H3/t8-,9+,10-,11+/m0/s1
InChIKey PVJSGAQWUVWNKN-ZRUFSTJUSA-N
Mol Weight 198.26 g/mol
Molecular Formula C11H18O3
Exact Mass 198.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 11GPM16MWTd
Name 6H-2,5a-Epoxy-1-benzoxepin-4-ol, octahydro-2-methyl-, (2.alpha.,4.beta.,5a.alpha.,9a.beta.)-
CAS Registry Number 97149-49-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O3
InChI InChI=1S/C11H18O3/c1-10-6-8(12)7-11(14-10)5-3-2-4-9(11)13-10/h8-9,12H,2-7H2,1H3/t8-,9+,10-,11+/m0/s1
InChIKey PVJSGAQWUVWNKN-ZRUFSTJUSA-N
Molecular Weight 198.262 g/mol
SMILES O[C@@]1(C[C@@]23O[C@](O[C@@]2(CCCC3)[H])(C1)C)[H]
SPLASH splash10-002o-9400000000-84481e636fb35590da9f
Source of Spectrum KC-1985-286-12
Synonyms (1R,6R,8S,10R)-8-methyl-7,12-dioxatricyclo[6.3.1.0(1,6)]dodecan-10-ol 1-Methyl-2,12-dioxabicyclo[6.3.1.0(3,8)]dodecan-10-ol
Wiley ID 1195556