| SpectraBase Spectrum ID |
1X9HKTkRAsz |
| Name |
Benzene, [(4,5,5-trimethyl-1-cyclopenten-1-yl)methyl]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
200.156500644 u |
| Formula |
C15H20 |
| InChI |
InChI=1S/C15H20/c1-12-9-10-14(15(12,2)3)11-13-7-5-4-6-8-13/h4-8,10,12H,9,11H2,1-3H3 |
| InChIKey |
WOEMTOOTGIVUEE-UHFFFAOYSA-N |
| Molecular Weight |
200.325 g/mol |
| SMILES |
C=1(CC2=CC=CC=C2)C(C)(C)C(C)CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.917057 |