| SpectraBase Spectrum ID |
6Okgdq6d6I3 |
| Name |
(5S)-(4-Ethoxybenzoyl)-6,6-dimethyl-6,7-dihydro-5H-[1,2,3]triazolo[5,1-b][1,3,4]thiadiazine-3-carboxylic acid ethyl ester |
| Appearance |
White powder |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H22N4O4S |
| InChI |
InChI=1S/C18H22N4O4S/c1-5-25-12-9-7-11(8-10-12)14(23)15-18(3,4)20-22-16(27-15)13(19-21-22)17(24)26-6-2/h7-10,15,20H,5-6H2,1-4H3/t15-/m1/s1 |
| InChIKey |
YGUSHOPLXFRZIZ-OAHLLOKOSA-N |
| Instrument Name |
GCMS-QP2010 Ultra |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.2554 |
| Molecular Weight |
390.458 g/mol |
| SMILES |
N1[n]2c(S[C@@](C1(C)C)(C(c1ccc(cc1)OCC)=O)[H])c(nn2)C(=O)OCC |
| SPLASH |
splash10-006t-2901000000-d18c219c8f9753ec8e22 |
| Source of Spectrum |
Y-54-144-8l |
| Wiley ID |
1877784 |
![(5S)-(4-Ethoxybenzoyl)-6,6-dimethyl-6,7-dihydro-5H-[1,2,3]triazolo[5,1-b][1,3,4]thiadiazine-3-carboxylic acid ethyl ester](/api/spectrum/6Okgdq6d6I3/structure.png?h=300&w=458 "(5S)-(4-Ethoxybenzoyl)-6,6-dimethyl-6,7-dihydro-5H-[1,2,3]triazolo[5,1-b][1,3,4]thiadiazine-3-carboxylic acid ethyl ester")
