SpectraBase Spectrum ID |
BlNbXjVQhOw |
Name |
(R)-2-Phenyl-2,3,3-trimethylbutanol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
192.151415263 u |
Formula |
C13H20O |
InChI |
InChI=1S/C13H20O/c1-12(2,3)13(4,10-14)11-8-6-5-7-9-11/h5-9,14H,10H2,1-4H3/t13-/m0/s1 |
InChIKey |
AWWBGOCZXZIPNB-ZDUSSCGKSA-N |
Molecular Weight |
192.302 g/mol |
SMILES |
C(C)(C)(C)[C@](C1=CC=CC=C1)(CO)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.966395 |