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

*Links on SpectraBase are not permalinks.
2-(3-carbomethoxy-5-methoxy-7-methyl-4H-1,4-benzothiazin-2-yl)-5-methoxy-7-methyl-4H-1,4-benzothiazine-3-carboxylic acid methyl ester
SpectraBase Compound ID 7eMrJsKmK2b
InChI InChI=1S/C24H24N2O6S2/c1-11-7-13(29-3)17-15(9-11)33-21(19(25-17)23(27)31-5)22-20(24(28)32-6)26-18-14(30-4)8-12(2)10-16(18)34-22/h7-10,25-26H,1-6H3
InChIKey QEOKKCUDFAOSJR-UHFFFAOYSA-N
Mol Weight 500.58 g/mol
Molecular Formula C24H24N2O6S2
Exact Mass 500.107579 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 3FNN3yJqKfl
Name 2-(3-carbomethoxy-5-methoxy-7-methyl-4H-1,4-benzothiazin-2-yl)-5-methoxy-7-methyl-4H-1,4-benzothiazine-3-carboxylic acid methyl ester
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H24N2O6S2
InChI InChI=1S/C24H24N2O6S2/c1-11-7-13(29-3)17-15(9-11)33-21(19(25-17)23(27)31-5)22-20(24(28)32-6)26-18-14(30-4)8-12(2)10-16(18)34-22/h7-10,25-26H,1-6H3
InChIKey QEOKKCUDFAOSJR-UHFFFAOYSA-N
Molecular Weight 500.584 g/mol
SMILES N1c2c(SC(C3=C(Nc4c(S3)cc(cc4OC)C)C(=O)OC)=C1C(=O)OC)cc(cc2OC)C
SPLASH splash10-0udi-0030090000-8a808375d3152dc4614a
Source of Spectrum J-66-6965-16
Synonyms 5-methoxy-2-(5-methoxy-3-methoxycarbonyl-7-methyl-4H-1,4-benzothiazin-2-yl)-7-methyl-4H-1,4-benzothiazine-3-carboxylic acid methyl ester
Wiley ID 1536041