SpectraBase Spectrum ID |
BFgsjjyKWKu |
Name |
2-Isopropyl-7,7-dimethylbenzo[C]fluorene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
286.172150708 u |
Formula |
C22H22 |
InChI |
InChI=1S/C22H22/c1-14(2)16-10-9-15-11-12-20-21(18(15)13-16)17-7-5-6-8-19(17)22(20,3)4/h5-14H,1-4H3 |
InChIKey |
RQWYTZFTLRPVLR-UHFFFAOYSA-N |
Molecular Weight |
286.418 g/mol |
SMILES |
C12=C(C3=C(C=C2)C(C2=C3C=CC=C2)(C)C)C=C(C=C1)C(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.931831 |