| SpectraBase Spectrum ID |
B0PJvF7vn3g |
| Name |
N-(3-Ethoxycarbonyl-4,5,6,7-tetrahydrobenzo[b]thien-2-yl)-2-(4-nitrophenyl hydrazono)-3-oxobutanamide |
| Appearance |
Orange solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H22N4O6S |
| InChI |
InChI=1S/C21H22N4O6S/c1-3-31-21(28)17-15-6-4-5-7-16(15)32-20(17)22-19(27)18(12(2)26)24-23-13-8-10-14(11-9-13)25(29)30/h8-11,23H,3-7H2,1-2H3,(H,22,27) |
| InChIKey |
NYEDMDFFKHDSOO-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GCMS-QP 1000 EX or HP GCMS 5988-A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3998/ark.5550190.0009.h28 |
| Molecular Weight |
458.489 g/mol |
| SMILES |
N(c1sc2c(c1C(OCC)=O)CCCC2)C(C(=NNc1ccc(cc1)[N+]([O-])=O)C(C)=O)=O |
| SPLASH |
splash10-056r-0960400000-7bcea8a93ca574926107 |
| Source of Spectrum |
ARK-2008-303-4h |
| Wiley ID |
1869395 |
![N-(3-Ethoxycarbonyl-4,5,6,7-tetrahydrobenzo[b]thien-2-yl)-2-(4-nitrophenyl hydrazono)-3-oxobutanamide](/api/spectrum/B0PJvF7vn3g/structure.png?h=300&w=458 "N-(3-Ethoxycarbonyl-4,5,6,7-tetrahydrobenzo[b]thien-2-yl)-2-(4-nitrophenyl hydrazono)-3-oxobutanamide")
