SpectraBase Spectrum ID |
FvhUrEbGkX9 |
Name |
6-[1-(2-Hydroxyethylimino)ethyl]tricyclo[8.2.2.24,7] hexadeca-1(13),4,6,10(14),11,15-hexaen-5-ol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
309.172878983 u |
Formula |
C20H23NO2 |
InChI |
InChI=1S/C20H23NO2/c1-14(21-12-13-22)19-17-8-6-15-2-4-16(5-3-15)7-9-18(11-10-17)20(19)23/h2-5,10-11,22-23H,6-9,12-13H2,1H3/b21-14+ |
InChIKey |
HWRUGKINBRCBDX-KGENOOAVSA-N |
Molecular Weight |
309.409 g/mol |
SMILES |
C1=CC2=CC=C1CCC=1C=CC(CC2)=C(C1\C(=N\CCO)C)O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.833359 |