SpectraBase Spectrum ID |
LjkzFE71tOe |
Name |
Glutaric acid, cyclohexylmethyl 2-nitrophenyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
349.152537459 u |
Formula |
C18H23NO6 |
InChI |
InChI=1S/C18H23NO6/c20-17(24-13-14-7-2-1-3-8-14)11-6-12-18(21)25-16-10-5-4-9-15(16)19(22)23/h4-5,9-10,14H,1-3,6-8,11-13H2 |
InChIKey |
IQVDFPJMDOUWMK-UHFFFAOYSA-N |
Molecular Weight |
349.383 g/mol |
SMILES |
C(CCC(OCC1CCCCC1)=O)C(OC=1C=CC=CC1N(=O)=O)=O |