| SpectraBase Spectrum ID |
265ZcRA63jw |
| Name |
2-benzoyl-4-cycloheptyl-1,4-benzothiazin-3-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H23NO2S |
| InChI |
InChI=1S/C22H23NO2S/c24-20(16-10-4-3-5-11-16)21-22(25)23(17-12-6-1-2-7-13-17)18-14-8-9-15-19(18)26-21/h3-5,8-11,14-15,17,21H,1-2,6-7,12-13H2 |
| InChIKey |
GGHYUCKPCFWDDR-UHFFFAOYSA-N |
| Molecular Weight |
365.491 g/mol |
| SMILES |
C1(C(N(C2CCCCCC2)c2c(S1)cccc2)=O)C(=O)c1ccccc1 |
| SPLASH |
splash10-0a4i-0902000000-3c619c96acda5791d8f0 |
| Source of Spectrum |
Y-29-1158-3 |
| Synonyms |
4-cycloheptyl-2-(phenylcarbonyl)-1,4-benzothiazin-3-one |
| Wiley ID |
1351461 |
