| SpectraBase Spectrum ID |
32hoLaAPWpB |
| Name |
Glutaric acid, 8-chlorooctyl 3-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/c20-13-5-3-1-2-4-6-14-26-18(22)11-8-12-19(23)27-17-10-7-9-16(15-17)21(24)25/h7,9-10,15H,1-6,8,11-14H2 |
| InChIKey |
GRVMIEQAGVPJFT-UHFFFAOYSA-N |
| Molecular Weight |
399.871 g/mol |
| SMILES |
C(CCC(OCCCCCCCCCl)=O)C(OC1=CC=CC(=C1)N(=O)=O)=O |
