| SpectraBase Spectrum ID |
HyMi6qDlxeE |
| Name |
1H-Pyrido[2,1-B]benzothiazol-1-one, 3-(diethylamino)-4-methyl-2-(trifluoroacetyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
382.096283456 u |
| Formula |
C18H17F3N2O2S |
| InChI |
InChI=1S/C18H17F3N2O2S/c1-4-22(5-2)14-10(3)17-23(11-8-6-7-9-12(11)26-17)16(25)13(14)15(24)18(19,20)21/h6-9H,4-5H2,1-3H3 |
| InChIKey |
PCMNUNMWWAIQAP-UHFFFAOYSA-N |
| Molecular Weight |
382.401 g/mol |
| SMILES |
C1=2N(C(=O)C(=C(C2C)N(CC)CC)C(C(F)(F)F)=O)C2=CC=CC=C2S1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.924869 |
![1H-Pyrido[2,1-b]benzothiazol-1-one, 3-(diethylamino)-4-methyl-2-(trifluoroacetyl)-](/api/spectrum/HyMi6qDlxeE/structure.png?h=300&w=458 "1H-Pyrido[2,1-b]benzothiazol-1-one, 3-(diethylamino)-4-methyl-2-(trifluoroacetyl)-")
