| SpectraBase Spectrum ID |
EW9qwIUGhF1 |
| Name |
4-(6,7-Dimethoxy-4-methylidene-4H-3,1-benzothiazin-2-yl)-2-methylbenzene-1,3-diol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
343.087829201 u |
| Formula |
C18H17NO4S |
| InChI |
InChI=1S/C18H17NO4S/c1-9-14(20)6-5-11(17(9)21)18-19-13-8-16(23-4)15(22-3)7-12(13)10(2)24-18/h5-8,20-21H,2H2,1,3-4H3 |
| InChIKey |
QOFGLVHWGKFVFO-UHFFFAOYSA-N |
| Molecular Weight |
343.397 g/mol |
| SMILES |
C=1(C(O)=C(C(=CC1)O)C)C1=NC=2C(=CC(=C(C2)OC)OC)C(S1)=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.900181 |
