SpectraBase Spectrum ID |
C9qy6yp2CdT |
Name |
Benzenemethanol, 3,5-bis(1,1-dimethylethyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
220.182715392 u |
Formula |
C15H24O |
InChI |
InChI=1S/C15H24O/c1-14(2,3)12-7-11(10-16)8-13(9-12)15(4,5)6/h7-9,16H,10H2,1-6H3 |
InChIKey |
VHYHRNYPVNFGNR-UHFFFAOYSA-N |
Molecular Weight |
220.356 g/mol |
SMILES |
OCC1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C |
Spectrum/Structure Validation Score (Raman) |
0.911894 |