| SpectraBase Spectrum ID |
Gf0F841c15z |
| Name |
Npdpa-m (ho-benzyl-) 2ac P1151 |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
339.183443666 u |
| Formula |
C21H25NO3 |
| InChI |
InChI=1S/C21H25NO3/c1-15(2)22(16(3)23)21(19-8-6-5-7-9-19)14-18-10-12-20(13-11-18)25-17(4)24/h5-13,15,21H,14H2,1-4H3 |
| InChIKey |
GHXWNCNGWKVEKE-UHFFFAOYSA-N |
| Molecular Weight |
339.435 g/mol |
| SMILES |
C=1C(=CC=CC1)C(N(C(C)=O)C(C)C)CC1=CC=C(C=C1)OC(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.94537 |
