| SpectraBase Spectrum ID |
GSqUTPot2sz |
| Name |
1-[3-Carbomethoxy-4-[p-chlorophenyl]-5,5-dimethyl-4,5-dihydro-2-furyl]-3-phenylurea |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
400.118984860 u |
| Formula |
C21H21ClN2O4 |
| InChI |
InChI=1S/C21H21ClN2O4/c1-21(2)17(13-9-11-14(22)12-10-13)16(19(25)27-3)18(28-21)24-20(26)23-15-7-5-4-6-8-15/h4-12,17H,1-3H3,(H2,23,24,26) |
| InChIKey |
WJFBDJBPSQONGZ-UHFFFAOYSA-N |
| Molecular Weight |
400.862 g/mol |
| SMILES |
C1(Cl)=CC=C(C2C(C(OC)=O)=C(NC(=O)NC3=CC=CC=C3)OC2(C)C)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.816589 |
![1-[3-Carbomethoxy-4-[p-chlorophenyl]-5,5-dimethyl-4,5-dihydro-2-furyl]-3-phenylurea](/api/spectrum/GSqUTPot2sz/structure.png?h=300&w=458 "1-[3-Carbomethoxy-4-[p-chlorophenyl]-5,5-dimethyl-4,5-dihydro-2-furyl]-3-phenylurea")
