| SpectraBase Spectrum ID |
BMbIAglpsN8 |
| Name |
Dimethyl 2-[(ethoxycarbonyl)(3,4-dihydro-2H-1,4-benzothiazin-3-ylidene)methyl] fumate |
| Alternate Name(s) |
3-ethyl 1,2-dimethyl (1Z,3Z)-3-(2H-1,4-benzothiazin-3(4H)-ylidene)-1-propene-1,2,3-tricarboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H19NO6S |
| InChI |
InChI=1S/C18H19NO6S/c1-4-25-18(22)16(11(17(21)24-3)9-15(20)23-2)13-10-26-14-8-6-5-7-12(14)19-13/h5-9,19H,4,10H2,1-3H3/b11-9-,16-13- |
| InChIKey |
IQCGPJJSUZCTEI-SQHGXFKPSA-N |
| Molecular Weight |
377.411 g/mol |
| SMILES |
N1c2ccccc2SC\C1=C\(\C(=C\C(=O)OC)C(=O)OC)C(=O)OCC |
| SPLASH |
splash10-004i-0009000000-e0a4147914c320fbb3a9 |
| Source of Spectrum |
F-55-7922-13 |
| Wiley ID |
838325 |
