| SpectraBase Spectrum ID |
6KIOqm65Iq2 |
| Name |
5-Methyl-3-(4-tolyl)-2-(2,3,3-trichloro-1-nitroallylidene)thiazolidin-4-one |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H11Cl3N2O3S |
| InChI |
InChI=1S/C14H11Cl3N2O3S/c1-7-3-5-9(6-4-7)18-13(20)8(2)23-14(18)11(19(21)22)10(15)12(16)17/h3-6,8H,1-2H3 |
| InChIKey |
LXFAMMQJNZIPTR-UHFFFAOYSA-N |
| Instrument Name |
Hewlett Packard 'MS 5989B' |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.10.170 |
| Molecular Weight |
393.672 g/mol |
| Reported Formula |
C14H11Cl3N2O3S |
| SMILES |
C(Cl)(=C(Cl)Cl)C(=C1N(C(C(S1)C)=O)c1ccc(cc1)C)[N+]([O-])=O |
| SPLASH |
splash10-0002-0091000000-f03762b9159830afd8e1 |
| Sample Comments |
isomeric ratio (9:1) |
| Source of Spectrum |
BJO-10-SM12-32 |
| Wiley ID |
1853928 |
