SpectraBase Spectrum ID |
Ib6SKy3Na7T |
Name |
()-4-(Chroman-2-yl)-3-methylbutan-1-ol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
220.146329882 u |
Formula |
C14H20O2 |
InChI |
InChI=1S/C14H20O2/c1-11(8-9-15)10-13-7-6-12-4-2-3-5-14(12)16-13/h2-5,11,13,15H,6-10H2,1H3 |
InChIKey |
CFJRSJDYPMVRAX-UHFFFAOYSA-N |
Molecular Weight |
220.312 g/mol |
SMILES |
C1=2OC(CCC2C=CC=C1)CC(CCO)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.937136 |