| SpectraBase Spectrum ID |
7ZjCQgAHDpi |
| Name |
Glutaric acid, 2-(2-methyl-5-nitroimidazol-1-yl)ethyl 2-methylhex-3-yl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
383.205635660 u |
| Formula |
C18H29N3O6 |
| InChI |
InChI=1S/C18H29N3O6/c1-5-7-15(13(2)3)27-18(23)9-6-8-17(22)26-11-10-20-14(4)19-12-16(20)21(24)25/h12-13,15H,5-11H2,1-4H3 |
| InChIKey |
JJFMIIIUBMOSLK-UHFFFAOYSA-N |
| Molecular Weight |
383.445 g/mol |
| SMILES |
C(C(OC(=O)CCCC(OCCN1C(C)=NC=C1N(=O)=O)=O)C(C)C)CC |
