| SpectraBase Spectrum ID |
6chmhHHTcY5 |
| Name |
(2Z)-2-(2-Keto-2-methoxy-1-phthalimido-ethylidene)-3,6-dihydro-1,3-thiazine-4-carboxylic acid ethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
388.072907411 u |
| Formula |
C18H16N2O6S |
| InChI |
InChI=1S/C18H16N2O6S/c1-3-26-17(23)12-8-9-27-14(19-12)13(18(24)25-2)20-15(21)10-6-4-5-7-11(10)16(20)22/h4-8,19H,3,9H2,1-2H3/b14-13- |
| InChIKey |
UWHOMKIBWMIDHT-YPKPFQOOSA-N |
| Molecular Weight |
388.394 g/mol |
| SMILES |
C=1(N\C(=C/(N2C(C3=CC=CC=C3C2=O)=O)C(=O)OC)SCC1)C(=O)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.904146 |
