SpectraBase Spectrum ID |
B8ISTEnq85Z |
Name |
Trans-1,2-dimethyl-1-phenyl-2,3-dihydro-1H-indene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
222.140850580 u |
Formula |
C17H18 |
InChI |
InChI=1S/C17H18/c1-13-12-14-8-6-7-11-16(14)17(13,2)15-9-4-3-5-10-15/h3-11,13H,12H2,1-2H3/t13-,17-/m1/s1 |
InChIKey |
FFRCMONMVXEPAP-CXAGYDPISA-N |
Molecular Weight |
222.331 g/mol |
SMILES |
[C@@]1(C2=CC=CC=C2)([C@@](CC2=CC=CC=C12)(C)[H])C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.969439 |