| SpectraBase Spectrum ID |
CmGhBPBJ9iX |
| Name |
5-Benzoyl-[5,7-dihydrospiro[1,2,3]triazolo[5,1-b][1,3,4]thiadiazine-6,1'-cyclopentane]-3-carboxylic acid ethyl ester |
| Appearance |
Beige powder |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H20N4O3S |
| InChI |
InChI=1S/C18H20N4O3S/c1-2-25-17(24)13-16-22(21-19-13)20-18(10-6-7-11-18)15(26-16)14(23)12-8-4-3-5-9-12/h3-5,8-9,15,20H,2,6-7,10-11H2,1H3 |
| InChIKey |
LRWOSPGMDGVWQH-UHFFFAOYSA-N |
| Instrument Name |
GCMS-QP2010 Ultra |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.2554 |
| Molecular Weight |
372.443 g/mol |
| SMILES |
N1[n]2nnc(c2SC(C11CCCC1)C(c1ccccc1)=O)C(=O)OCC |
| SPLASH |
splash10-0a6r-8901000000-4ebf99562a423523a04a |
| Source of Spectrum |
Y-54-144-9a |
| Wiley ID |
1877785 |
![5-Benzoyl-[5,7-dihydrospiro[1,2,3]triazolo[5,1-b][1,3,4]thiadiazine-6,1'-cyclopentane]-3-carboxylic acid ethyl ester](/api/spectrum/CmGhBPBJ9iX/structure.png?h=300&w=458 "5-Benzoyl-[5,7-dihydrospiro[1,2,3]triazolo[5,1-b][1,3,4]thiadiazine-6,1'-cyclopentane]-3-carboxylic acid ethyl ester")
