| SpectraBase Spectrum ID |
3hskskoE46i |
| Name |
Trans-1-methyl-1,2-di(4-methylphenyl)cyclopropane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
236.156500644 u |
| Formula |
C18H20 |
| InChI |
InChI=1S/C18H20/c1-13-4-8-15(9-5-13)17-12-18(17,3)16-10-6-14(2)7-11-16/h4-11,17H,12H2,1-3H3/t17-,18-/m0/s1 |
| InChIKey |
DYUQNQMTYAIWAK-ROUUACIJSA-N |
| Molecular Weight |
236.358 g/mol |
| SMILES |
[C@]1([C@](C2=CC=C(C=C2)C)(C1)[H])(C=1C=CC(=CC1)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.955135 |
