| SpectraBase Spectrum ID |
1KaGuXahBw7 |
| Name |
2-(2'-Methoxy-5'-methylphenyl)-2,3,3-trimethylcyclopentanol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
248.177630011 u |
| Formula |
C16H24O2 |
| InChI |
InChI=1S/C16H24O2/c1-11-6-7-13(18-5)12(10-11)16(4)14(17)8-9-15(16,2)3/h6-7,10,14,17H,8-9H2,1-5H3/t14-,16+/m1/s1 |
| InChIKey |
IBRCCJYTLQPHOT-ZBFHGGJFSA-N |
| Molecular Weight |
248.366 g/mol |
| SMILES |
C=1([C@@]2(C(CC[C@]2(O)[H])(C)C)C)C(=CC=C(C1)C)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.965632 |
