| SpectraBase Spectrum ID |
9WNMoJkdtAp |
| Name |
3-(4-Methoxyphenyl)-5-methyl-2-(2,3,3-trichloro-1-nitroallylidene)-thiazolidin-4-one |
| Appearance |
Light-brown solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H11Cl3N2O4S |
| InChI |
InChI=1S/C14H11Cl3N2O4S/c1-7-13(20)18(8-3-5-9(23-2)6-4-8)14(24-7)11(19(21)22)10(15)12(16)17/h3-7H,1-2H3 |
| InChIKey |
QQBBHZMZICOMAR-UHFFFAOYSA-N |
| Instrument Name |
Hewlett Packard 'MS 5989B' |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.10.170 |
| Molecular Weight |
409.671 g/mol |
| Reported Formula |
C14H11Cl3N2O4S |
| SMILES |
C(Cl)(=C(Cl)Cl)C(=C1N(C(C(S1)C)=O)c1ccc(cc1)OC)[N+]([O-])=O |
| SPLASH |
splash10-00di-0900000000-d452612b126aa36c7697 |
| Sample Comments |
isomeric ratio (3:1) |
| Source of Spectrum |
BJO-10-SM11-31 |
| Wiley ID |
1853927 |
