| SpectraBase Spectrum ID |
Jd50aH6VtAQ |
| Name |
N-Tert-butoxycarbonyl-N-[(E,1R)-1,3-diphenylallyl]carbamic acid tert-butyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
409.225308478 u |
| Formula |
C25H31NO4 |
| InChI |
InChI=1S/C25H31NO4/c1-24(2,3)29-22(27)26(23(28)30-25(4,5)6)21(20-15-11-8-12-16-20)18-17-19-13-9-7-10-14-19/h7-18,21H,1-6H3/b18-17+/t21-/m1/s1 |
| InChIKey |
AXGZLRMVIAOROA-RURFIKTLSA-N |
| Molecular Weight |
409.526 g/mol |
| SMILES |
C(N(C(OC(C)(C)C)=O)[C@](\C=C\C=1C=CC=CC1)(C1=CC=CC=C1)[H])(OC(C)(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.889399 |
![N-tert-butoxycarbonyl-N-[(E,1R)-1,3-diphenylallyl]carbamic acid tert-butyl ester](/api/spectrum/Jd50aH6VtAQ/structure.png?h=300&w=458 "N-tert-butoxycarbonyl-N-[(E,1R)-1,3-diphenylallyl]carbamic acid tert-butyl ester")
