| SpectraBase Spectrum ID |
7f3qoBbxcnL |
| Name |
3-(4-benzyl-3-keto-1,4-benzothiazin-2-yl)-3-keto-propionic acid methyl ester |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H17NO4S |
| InChI |
InChI=1S/C19H17NO4S/c1-24-17(22)11-15(21)18-19(23)20(12-13-7-3-2-4-8-13)14-9-5-6-10-16(14)25-18/h2-10,18H,11-12H2,1H3 |
| InChIKey |
WWLQZJFYMOSWAF-UHFFFAOYSA-N |
| Molecular Weight |
355.408 g/mol |
| SMILES |
C1(N(c2c(SC1C(CC(=O)OC)=O)cccc2)Cc1ccccc1)=O |
| SPLASH |
splash10-03di-0930000000-e9c9c437602f359f1eb6 |
| Source of Spectrum |
Y-29-1158-3 |
| Synonyms |
3-oxo-3-[3-oxo-4-(phenylmethyl)-1,4-benzothiazin-2-yl]propanoic acid methyl ester
methyl 3-(4-benzyl-3-oxo-1,4-benzothiazin-2-yl)-3-oxo-propanoate
methyl 3-oxidanylidene-3-[3-oxidanylidene-4-(phenylmethyl)-1,4-benzothiazin-2-yl]propanoate |
| Wiley ID |
1345211 |
