| SpectraBase Spectrum ID |
t7q8cxGZXk |
| Name |
Eseroline, (4-isopropylphenyl)carbamate(ester) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
379.225977184 u |
| Formula |
C23H29N3O2 |
| InChI |
InChI=1S/C23H29N3O2/c1-15(2)16-6-8-17(9-7-16)24-22(27)28-18-10-11-20-19(14-18)23(3)12-13-25(4)21(23)26(20)5/h6-11,14-15,21H,12-13H2,1-5H3,(H,24,27) |
| InChIKey |
NKJRRVBTMYRXRB-UHFFFAOYSA-N |
| Molecular Weight |
379.504 g/mol |
| SMILES |
C1=C(C=CC2=C1C1(CCN(C1N2C)C)C)OC(NC1=CC=C(C=C1)C(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.876904 |
