For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-(3-Methanoyl-4-methoxy-6-methyl-2-oxidanyl-phenyl)carbonyloxy-2,5-dimethyl-4,6-bis(oxidanyl)benzoic acid
SpectraBase Compound ID JKIptMtbECg
InChI InChI=1S/C19H18O9/c1-7-5-11(27-4)10(6-20)16(23)12(7)19(26)28-17-8(2)13(18(24)25)14(21)9(3)15(17)22/h5-6,21-23H,1-4H3,(H,24,25)
InChIKey HEDMFNAWESICHB-UHFFFAOYSA-N
Mol Weight 390.34 g/mol
Molecular Formula C19H18O9
Exact Mass 390.095082 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID HyDRGd1mgqj
Name 3-(3-Methanoyl-4-methoxy-6-methyl-2-oxidanyl-phenyl)carbonyloxy-2,5-dimethyl-4,6-bis(oxidanyl)benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18O9
InChI InChI=1S/C19H18O9/c1-7-5-11(27-4)10(6-20)16(23)12(7)19(26)28-17-8(2)13(18(24)25)14(21)9(3)15(17)22/h5-6,21-23H,1-4H3,(H,24,25)
InChIKey HEDMFNAWESICHB-UHFFFAOYSA-N
Molecular Weight 390.344 g/mol
SMILES Oc1c(C(Oc2c(c(c(c(c2O)C)O)C(=O)O)C)=O)c(cc(c1C=O)OC)C
SPLASH splash10-0006-0900000000-db9c8d4b667ba24cf1bc
Source of Spectrum B-52-840-6
Synonyms 5-(3-formyl-2-hydroxy-4-methoxy-6-methyl-benzoyl)oxy-2,4-dihydroxy-3,6-dimethyl-benzoic acid 5-[(3-formyl-2-hydroxy-4-methoxy-6-methylphenyl)-oxomethoxy]-2,4-dihydroxy-3,6-dimethylbenzoic acid
Wiley ID 810844