SpectraBase Spectrum ID |
JsHwlshYARx |
Name |
1,6-Dimethyl-4-isopropyl-7-methoxynaphthalene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
228.151415263 u |
Formula |
C16H20O |
InChI |
InChI=1S/C16H20O/c1-10(2)13-7-6-11(3)14-9-16(17-5)12(4)8-15(13)14/h6-10H,1-5H3 |
InChIKey |
CTYYPXUXVBFGNI-UHFFFAOYSA-N |
Molecular Weight |
228.335 g/mol |
SMILES |
C=1C=2C(=CC=C(C2C=C(C1C)OC)C)C(C)C |
Spectrum/Structure Validation Score (Raman) |
0.95024 |