SpectraBase Spectrum ID |
AncNGAQeqwn |
Name |
1-(2,2-Dimethyl-1,3-dihydroinden-1-yl)-2,2-dimethyl-1,3-dihydroindene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
290.203450837 u |
Formula |
C22H26 |
InChI |
InChI=1S/C22H26/c1-21(2)13-15-9-5-7-11-17(15)19(21)20-18-12-8-6-10-16(18)14-22(20,3)4/h5-12,19-20H,13-14H2,1-4H3 |
InChIKey |
KAJSMSUYAXOSJP-UHFFFAOYSA-N |
SMILES |
C1(C2C(CC=3C2=CC=CC3)(C)C)C(CC2=C1C=CC=C2)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.899672 |