| SpectraBase Spectrum ID |
HgNH6Nis2JR |
| Name |
N,N-bis(1-Acetoxy-4-chloro-2-naphthyl methyl)-acetamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
523.095328240 u |
| Formula |
C28H23Cl2NO5 |
| InChI |
InChI=1S/C28H23Cl2NO5/c1-16(32)31(14-19-12-25(29)21-8-4-6-10-23(21)27(19)35-17(2)33)15-20-13-26(30)22-9-5-7-11-24(22)28(20)36-18(3)34/h4-13H,14-15H2,1-3H3 |
| InChIKey |
NURYVDDNVQQAKQ-UHFFFAOYSA-N |
| Molecular Weight |
524.400 g/mol |
| SMILES |
C1=CC2=C(C=C1)C(=CC(=C2OC(=O)C)CN(CC1=C(C2=C(C(=C1)Cl)C=CC=C2)OC(=O)C)C(=O)C)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.827033 |
