| SpectraBase Spectrum ID |
DhNIQjoQMJb |
| Name |
Benzoic acid, 4-(nitromethyl)-, methyl ester |
| Alternate Name(s) |
Methyl 4-(nitromethyl)benzoate
4-(nitromethyl)benzoic acid methyl ester |
| CAS Registry Number |
54833-06-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H9NO4 |
| InChI |
InChI=1S/C9H9NO4/c1-14-9(11)8-4-2-7(3-5-8)6-10(12)13/h2-5H,6H2,1H3 |
| InChIKey |
CMQVUFLONNTQEY-UHFFFAOYSA-N |
| Molecular Weight |
195.174 g/mol |
| SMILES |
COC(c1ccc(cc1)CN(=O)=O)=O |
| SPLASH |
splash10-0002-6900000000-35802a513e788997bc16 |
| Source of Spectrum |
AD-0-3044-0 |
| Wiley ID |
22032 |
