| SpectraBase Spectrum ID |
NNxJ1tt7sH |
| Name |
1-Naphthalenecarbamic acid, 2-[(2,4-dichloro-3,5-xylyl)oxy]ethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
403.074198873 u |
| Formula |
C21H19Cl2NO3 |
| InChI |
InChI=1S/C21H19Cl2NO3/c1-13-12-18(20(23)14(2)19(13)22)26-10-11-27-21(25)24-17-9-5-7-15-6-3-4-8-16(15)17/h3-9,12H,10-11H2,1-2H3,(H,24,25) |
| InChIKey |
SUTVRKOYDUQJND-UHFFFAOYSA-N |
| Molecular Weight |
404.293 g/mol |
| SMILES |
N(C1=CC=CC=2C=CC=CC12)C(=O)OCCOC=1C=C(C)C(Cl)=C(C1Cl)C |
| Spectrum/Structure Validation Score (Raman) |
0.881342 |
![1-Naphthalenecarbamic acid, 2-[(2,4-dichloro-3,5-xylyl)oxy]ethyl ester](/api/spectrum/NNxJ1tt7sH/structure.png?h=300&w=458 "1-Naphthalenecarbamic acid, 2-[(2,4-dichloro-3,5-xylyl)oxy]ethyl ester")
