SpectraBase Spectrum ID |
7TPOg95nlTf |
Name |
N-{2-[3-(o-Methoxyphenyl)propyl]-1,2,3,4-tetrahydro-5-isoquinolyl}veratramide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
460.236207514 u |
Formula |
C28H32N2O4 |
InChI |
InChI=1S/C28H32N2O4/c1-32-25-12-5-4-8-20(25)10-7-16-30-17-15-23-22(19-30)9-6-11-24(23)29-28(31)21-13-14-26(33-2)27(18-21)34-3/h4-6,8-9,11-14,18H,7,10,15-17,19H2,1-3H3,(H,29,31) |
InChIKey |
GQCVBBLPVMISKK-UHFFFAOYSA-N |
Molecular Weight |
460.574 g/mol |
SMILES |
N(C=1C=2CCN(CC2C=CC1)CCCC=1C=CC=CC1OC)C(C1=CC(=C(C=C1)OC)OC)=O |
Spectrum/Structure Validation Score (Raman) |
0.977118 |