SpectraBase Spectrum ID |
6CtPGxybmzp |
Name |
1-[(3-Hydroxypropyl)-3,4-dihydronaphthalene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
188.120115134 u |
Formula |
C13H16O |
InChI |
InChI=1S/C13H16O/c14-10-4-8-12-7-3-6-11-5-1-2-9-13(11)12/h1-2,5,7,9,14H,3-4,6,8,10H2 |
InChIKey |
QCFWKOMKDVHAEE-UHFFFAOYSA-N |
Molecular Weight |
188.270 g/mol |
SMILES |
C=1(C=2C(=CC=CC2)CCC1)CCCO |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.971111 |