| SpectraBase Spectrum ID |
J8kqaX6D4oN |
| Name |
4-Cyanomethyl-3-nitrophenyl toluene-4-sulfonate |
| Alternate Name(s) |
4-(cyanomethyl)-3-nitrophenyl 4-methylbenzenesulfonate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H12N2O5S |
| InChI |
InChI=1S/C15H12N2O5S/c1-11-2-6-14(7-3-11)23(20,21)22-13-5-4-12(8-9-16)15(10-13)17(18)19/h2-7,10H,8H2,1H3 |
| InChIKey |
MBLCGLNJUSNIIR-UHFFFAOYSA-N |
| Molecular Weight |
332.330 g/mol |
| SMILES |
c1(ccc(cc1)S(=O)(=O)Oc1cc(c(cc1)CC#N)N(=O)=O)C |
| SPLASH |
splash10-05mp-6900000000-af852849d1e860461e43 |
| Source of Spectrum |
F-53-4747-11 |
| Wiley ID |
801393 |
