| SpectraBase Spectrum ID |
Htc5Ladz3Rs |
| Name |
4-(3-Amino-4-methoxyphenyl)-3-(4-methoxyphenyl)hexan-3-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
329.199093730 u |
| Formula |
C20H27NO3 |
| InChI |
InChI=1S/C20H27NO3/c1-5-17(14-7-12-19(24-4)18(21)13-14)20(22,6-2)15-8-10-16(23-3)11-9-15/h7-13,17,22H,5-6,21H2,1-4H3 |
| InChIKey |
RVEROFWVDRQLNI-UHFFFAOYSA-N |
| Molecular Weight |
329.440 g/mol |
| SMILES |
C1=C(C=CC(=C1)C(C(C1=CC=C(C(=C1)N)OC)CC)(CC)O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.966769 |
