| SpectraBase Spectrum ID |
9k0MaeGTQSw |
| Name |
bis-(1-(3,4-Methylenedioxyphenyl)-propan-2-yl)amine, N-(acetyl) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
383.173272904 u |
| Formula |
C22H25NO5 |
| InChI |
InChI=1S/C22H25NO5/c1-14(8-17-4-6-19-21(10-17)27-12-25-19)23(16(3)24)15(2)9-18-5-7-20-22(11-18)28-13-26-20/h4-7,10-11,14-15H,8-9,12-13H2,1-3H3 |
| InChIKey |
LPXCTDZUDOZUDS-UHFFFAOYSA-N |
| Molecular Weight |
383.444 g/mol |
| SMILES |
C1(=CC=C2C(=C1)OCO2)CC(N(C(CC1=CC2=C(C=C1)OCO2)C)C(C)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.938101 |
