| SpectraBase Spectrum ID |
1QaWCwNGX24 |
| Name |
Glutaric acid, 8-chlorooctyl 2-nitrophenyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
399.144865255 u |
| Formula |
C19H26ClNO6 |
| InChI |
InChI=1S/C19H26ClNO6/c20-14-7-3-1-2-4-8-15-26-18(22)12-9-13-19(23)27-17-11-6-5-10-16(17)21(24)25/h5-6,10-11H,1-4,7-9,12-15H2 |
| InChIKey |
YAKFMOGSBNBERQ-UHFFFAOYSA-N |
| Molecular Weight |
399.871 g/mol |
| SMILES |
C(CCC(OCCCCCCCCCl)=O)C(OC=1C=CC=CC1N(=O)=O)=O |
