| SpectraBase Spectrum ID |
GsAIoF7kgHb |
| Name |
1,3-Pentanediol, 4-methyl-2-nitro- |
| Alternate Name(s) |
4-Methyl-2-nitro-pentane-1,3-diol |
| CAS Registry Number |
96040-05-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C6H13NO4 |
| InChI |
InChI=1S/C6H13NO4/c1-4(2)6(9)5(3-8)7(10)11/h4-6,8-9H,3H2,1-2H3 |
| InChIKey |
DKNHIOSPKGDBRB-UHFFFAOYSA-N |
| Molecular Weight |
163.173 g/mol |
| SMILES |
OC(C(CO)N(=O)=O)C(C)C |
| SPLASH |
splash10-0006-9000000000-07f1f6e30f76d63bfe62 |
| Source of Spectrum |
C-107-3605-0 |
| Wiley ID |
1159299 |
