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5,6-Benzo-3,8-dioxa-10-methyl-cis-bicyclo[8.1.0]undecan-2-one
SpectraBase Compound ID 3ndAxmcgRbs
InChI InChI=1S/C14H16O3/c1-14-6-12(14)13(15)17-8-11-5-3-2-4-10(11)7-16-9-14/h2-5,12H,6-9H2,1H3/t12-,14+/m0/s1
InChIKey MPADOSCPCMDKTO-GXTWGEPZSA-N
Mol Weight 232.28 g/mol
Molecular Formula C14H16O3
Exact Mass 232.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BFUhDCoD2
Name 5,6-Benzo-3,8-dioxa-10-methyl-cis-bicyclo[8.1.0]undecan-2-one
Alternate Name(s) 11a-methyl-1,1a,4,9,11,11a-hexahydro-2H-cyclopropa[d][2,7]benzodioxecin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O3
InChI InChI=1S/C14H16O3/c1-14-6-12(14)13(15)17-8-11-5-3-2-4-10(11)7-16-9-14/h2-5,12H,6-9H2,1H3/t12-,14+/m0/s1
InChIKey MPADOSCPCMDKTO-GXTWGEPZSA-N
Molecular Weight 232.279 g/mol
SMILES [C@]12([C@](C(OCc3c(COC2)cccc3)=O)(C1)[H])C
SPLASH splash10-0zml-6900000000-5ab1dc46916db121cfb3
Source of Spectrum C-119-8834-18
Wiley ID 760555