| SpectraBase Spectrum ID |
ITFe2Ge1nyI |
| Name |
5-Benzoyl-[5,7-dihydrospiro[[1,2,3]triazolo[5,1-b][1,3,4]thiadiazine-6,1'-cyclohexane-3-carboxylic acid ethyl ester |
| Appearance |
Beige powder |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H22N4O3S |
| InChI |
InChI=1S/C19H22N4O3S/c1-2-26-18(25)14-17-23(22-20-14)21-19(11-7-4-8-12-19)16(27-17)15(24)13-9-5-3-6-10-13/h3,5-6,9-10,16,21H,2,4,7-8,11-12H2,1H3 |
| InChIKey |
BRULFFUVXOBPIF-UHFFFAOYSA-N |
| Instrument Name |
GCMS-QP2010 Ultra |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.2554 |
| Molecular Weight |
386.470 g/mol |
| SMILES |
N1[n]2nnc(c2SC(C11CCCCC1)C(c1ccccc1)=O)C(=O)OCC |
| SPLASH |
splash10-0a4j-8901000000-3ab7b2b1882b785a748e |
| Source of Spectrum |
Y-54-145-9e |
| Wiley ID |
1877789 |
![5-Benzoyl-[5,7-dihydrospiro[[1,2,3]triazolo[5,1-b][1,3,4]thiadiazine-6,1'-cyclohexane-3-carboxylic acid ethyl ester](/api/spectrum/ITFe2Ge1nyI/structure.png?h=300&w=458 "5-Benzoyl-[5,7-dihydrospiro[[1,2,3]triazolo[5,1-b][1,3,4]thiadiazine-6,1'-cyclohexane-3-carboxylic acid ethyl ester")
