SpectraBase Spectrum ID |
7kwuUtTlxI6 |
Name |
2-[(Z)-1-Amyl-5-hydroxy-pent-3-enyl]phenol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
248.177630011 u |
Formula |
C16H24O2 |
InChI |
InChI=1S/C16H24O2/c1-2-3-4-9-14(10-7-8-13-17)15-11-5-6-12-16(15)18/h5-8,11-12,14,17-18H,2-4,9-10,13H2,1H3/b8-7- |
InChIKey |
BVJKLXPGYUVISJ-FPLPWBNLSA-N |
Molecular Weight |
248.366 g/mol |
SMILES |
C=1(C(O)=CC=CC1)C(C\C=C/CO)CCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.952077 |