| SpectraBase Spectrum ID |
IEZkudQS8t9 |
| Name |
2-Chloroethyl 3,5-dinitrobenzoate |
| Alternate Name(s) |
3,5-dinitrobenzoic acid 2-chloroethyl ester |
| CAS Registry Number |
78604-38-3 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H7ClN2O6 |
| InChI |
InChI=1S/C9H7ClN2O6/c10-1-2-18-9(13)6-3-7(11(14)15)5-8(4-6)12(16)17/h3-5H,1-2H2 |
| InChIKey |
NMYQUFDBMCNAHO-UHFFFAOYSA-N |
| Molecular Weight |
274.616 g/mol |
| SMILES |
c1(N(=O)=O)cc(N(=O)=O)cc(c1)C(=O)OCCCl |
| SPLASH |
splash10-0079-0090000000-2d8d8ca3a9ffc9e52e14 |
| Source of Spectrum |
I-59-1356-0 |
| Wiley ID |
1277570 |
