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1,2-Propanediol, 3-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-
SpectraBase Compound ID Hqr3sVMutX1
InChI InChI=1S/C12H16O6/c1-15-10-7(3-8(14)5-13)4-9-11(12(10)16-2)18-6-17-9/h4,8,13-14H,3,5-6H2,1-2H3
InChIKey KFHVABOPRNEKHN-UHFFFAOYSA-N
Mol Weight 256.25 g/mol
Molecular Formula C12H16O6
Exact Mass 256.094688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kv1bUsD0NtH
Name 1,2-Propanediol, 3-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-
Alternate Name(s) 3-(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)propane-1,2-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O6
InChI InChI=1S/C12H16O6/c1-15-10-7(3-8(14)5-13)4-9-11(12(10)16-2)18-6-17-9/h4,8,13-14H,3,5-6H2,1-2H3
InChIKey KFHVABOPRNEKHN-UHFFFAOYSA-N
Molecular Weight 256.254 g/mol
SMILES OCC(Cc1cc2c(c(c1OC)OC)OCO2)O
SPLASH splash10-0f9g-9200000000-502d3e759ad6bc1ad846
Source of Spectrum IY-2-5152-7
Wiley ID 1659510