| SpectraBase Spectrum ID |
51dIaXmIZ4F |
| Name |
1-Isothiocyanato-4-nitrobenzene |
| Alternate Name(s) |
4-Nitrophenyl isothiocyanate
Benzene, 1-isothiocyanato-4-nitro-
Isothiocyanic acid, p-nitrophenyl ester
p-Nitrophenyl isothiocyanate
EINECS 218-359-9 |
| CAS Registry Number |
2131-61-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C7H4N2O2S |
| InChI |
InChI=1S/C7H4N2O2S/c10-9(11)7-3-1-6(2-4-7)8-5-12/h1-4H |
| InChIKey |
NXHSSIGRWJENBH-UHFFFAOYSA-N |
| Molecular Weight |
180.181 g/mol |
| SMILES |
c1cc(ccc1N=C=S)N(=O)=O |
| SPLASH |
splash10-001i-7900000000-aab45cc5e5eaf23f28d7 |
| Source of Spectrum |
W6-12879-0-0 |
| Wiley ID |
88351 |
