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Cyclopenta[c]pyran-3(1H)-one, 6,7-bis(acetyloxy)hexahydro-1-methyl-
SpectraBase Compound ID 4C3xj3JMJYv
InChI InChI=1S/C13H18O6/c1-6-12-9(5-11(16)17-6)4-10(18-7(2)14)13(12)19-8(3)15/h6,9-10,12-13H,4-5H2,1-3H3
InChIKey CTXOCYWLHKJQSK-UHFFFAOYSA-N
Mol Weight 270.28 g/mol
Molecular Formula C13H18O6
Exact Mass 270.110338 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KSeoz6m4SrV
Name Cyclopenta[c]pyran-3(1H)-one, 6,7-bis(acetyloxy)hexahydro-1-methyl-
Alternate Name(s) 6-(acetyloxy)-1-methyl-3-oxooctahydrocyclopenta[c]pyran-7-yl acetate endo,endo-8,9-diacetoxy-exo-2-methyl-3-oxa-cis-bicyclo[4.3.0]nonan-4-one
CAS Registry Number 78309-86-1
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O6
InChI InChI=1S/C13H18O6/c1-6-12-9(5-11(16)17-6)4-10(18-7(2)14)13(12)19-8(3)15/h6,9-10,12-13H,4-5H2,1-3H3
InChIKey CTXOCYWLHKJQSK-UHFFFAOYSA-N
Molecular Weight 270.281 g/mol
SMILES C1(C2C(CC(OC2C)=O)CC1OC(=O)C)OC(=O)C
SPLASH splash10-01t9-0090000000-256141f2ef12598a475c
Source of Spectrum C-103-3470-0
Wiley ID 1273850