| SpectraBase Spectrum ID |
KTQr6R7EL9o |
| Name |
Urea, 1-(naphthalen-1-yl)-3-(2-pentafluorophenyloxyethyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
396.089718480 u |
| Formula |
C19H13F5N2O2 |
| InChI |
InChI=1S/C19H13F5N2O2/c20-13-14(21)16(23)18(17(24)15(13)22)28-9-8-25-19(27)26-12-7-3-5-10-4-1-2-6-11(10)12/h1-7H,8-9H2,(H2,25,26,27) |
| InChIKey |
ANKOVPUACIWSDJ-UHFFFAOYSA-N |
| Molecular Weight |
396.317 g/mol |
| SMILES |
C1(=C(C(=C(C(=C1F)OCCNC(NC1=C2C(C=CC=C2)=CC=C1)=O)F)F)F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.923626 |
