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

*Links on SpectraBase are not permalinks.
11H-Dibenzo[b,e][1,4]dioxepin-7-carboxylic acid, 2,4,9-trichloro-3,8-dimethoxy-1,6-dimethyl-11-oxo-, methyl ester
SpectraBase Compound ID 7QNDHqrNQPa
InChI InChI=1S/C19H15Cl3O7/c1-6-8-15(12(22)16(26-4)10(6)20)28-13-7(2)9(18(23)27-5)14(25-3)11(21)17(13)29-19(8)24/h1-5H3
InChIKey ORHLQGPMRWGBAF-UHFFFAOYSA-N
Mol Weight 461.68 g/mol
Molecular Formula C19H15Cl3O7
Exact Mass 459.988336 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 6dHsMYreOiu
Name 11H-Dibenzo[b,e][1,4]dioxepin-7-carboxylic acid, 2,4,9-trichloro-3,8-dimethoxy-1,6-dimethyl-11-oxo-, methyl ester
CAS Registry Number 72458-06-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H15Cl3O7
InChI InChI=1S/C19H15Cl3O7/c1-6-8-15(12(22)16(26-4)10(6)20)28-13-7(2)9(18(23)27-5)14(25-3)11(21)17(13)29-19(8)24/h1-5H3
InChIKey ORHLQGPMRWGBAF-UHFFFAOYSA-N
Molecular Weight 461.681 g/mol
SMILES c12c(Oc3c(c(C(=O)OC)c(c(c3OC2=O)Cl)OC)C)c(Cl)c(c(c1C)Cl)OC
SPLASH splash10-004i-0002900000-e7b2e31a6943bc8c1cbe
Source of Spectrum B-32-1861-0
Synonyms 3'-Chloro-O-methylgangaleoidin Methyl 2,4,9-trichloro-3,8-dimethoxy-1,6-dimethyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-7-carboxylate
Wiley ID 1390384