| SpectraBase Spectrum ID |
3EcbnFT4aG |
| Name |
(E)-1-(Benzo[d][1,3]dioxol-5-yl)-3-{2-[bis(2-chloroethyl)amino]-4-chlorothiazol-5-yl}prop-2-en-1-one |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H15Cl3N2O3S |
| InChI |
InChI=1S/C17H15Cl3N2O3S/c18-5-7-22(8-6-19)17-21-16(20)15(26-17)4-2-12(23)11-1-3-13-14(9-11)25-10-24-13/h1-4,9H,5-8,10H2/b4-2+ |
| InChIKey |
OQDVEEKLGDOSSY-DUXPYHPUSA-N |
| Instrument Name |
Shimadzu-GCMS-QP2010 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ardp.201900351 |
| Molecular Weight |
433.737 g/mol |
| SMILES |
C(\C=C\c1c(nc(s1)N(CCCl)CCCl)Cl)(=O)c1ccc2c(OCO2)c1 |
| SPLASH |
splash10-015d-9002000000-8cb659e77133fa042b63 |
| Source of Spectrum |
APC-353-14-5d |
| Wiley ID |
1839649 |
![(E)-1-(Benzo[d][1,3]dioxol-5-yl)-3-{2-[bis(2-chloroethyl)amino]-4-chlorothiazol-5-yl}prop-2-en-1-one](/api/spectrum/3EcbnFT4aG/structure.png?h=300&w=458 "(E)-1-(Benzo[d][1,3]dioxol-5-yl)-3-{2-[bis(2-chloroethyl)amino]-4-chlorothiazol-5-yl}prop-2-en-1-one")
