SpectraBase Spectrum ID |
5YS9ezYgi7D |
Name |
2-(2-Phenylethyl)chroman-4-ol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
254.130679818 u |
Formula |
C17H18O2 |
InChI |
InChI=1S/C17H18O2/c18-16-12-14(11-10-13-6-2-1-3-7-13)19-17-9-5-4-8-15(16)17/h1-9,14,16,18H,10-12H2 |
InChIKey |
NFMLEFBDXRYCKV-UHFFFAOYSA-N |
Molecular Weight |
254.329 g/mol |
SMILES |
C12=C(OC(CC2O)CCC=2C=CC=CC2)C=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.816158 |