| SpectraBase Spectrum ID |
CCILNCS8S5I |
| Name |
S-Ethyl (Z)-2-bromomethyl-3-(4-nitrophenyl)thioacrylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H12BrNO3S |
| InChI |
InChI=1S/C12H12BrNO3S/c1-2-18-12(15)10(8-13)7-9-3-5-11(6-4-9)14(16)17/h3-7H,2,8H2,1H3/b10-7+ |
| InChIKey |
LXUSXZMNARTYRT-JXMROGBWSA-N |
| Molecular Weight |
330.196 g/mol |
| SMILES |
c1(N(=O)=O)ccc(\C=C\(C(=O)SCC)CBr)cc1 |
| SPLASH |
splash10-014i-0089000000-e78739431dd4fdcce482 |
| Source of Spectrum |
KC-57-8461-13 |
| Synonyms |
S-ethyl (2Z)-2-(bromomethyl)-3-(4-nitrophenyl)-2-propenethioate
(Z)-2-(bromomethyl)-3-(4-nitrophenyl)-2-propenethioic acid S-ethyl ester
S-ethyl (Z)-2-(bromomethyl)-3-(4-nitrophenyl)prop-2-enethioate |
| Wiley ID |
1626052 |
