SpectraBase Spectrum ID |
2uvnaAKAYbl |
Name |
3,3',7,7'-Tetramethyl-1,1'-bi-(tricyclo-[3.3.0.0-(3,7)]-octyl) |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
270.234750966 u |
Formula |
C20H30 |
InChI |
InChI=1S/C20H30/c1-15-5-13-6-16(15,2)10-19(13,9-15)20-11-17(3)7-14(20)8-18(17,4)12-20/h13-14H,5-12H2,1-4H3/t13-,14-,15-,16+,17-,18+,19-,20? |
InChIKey |
QDUYSDFQOVKBHH-KQEJOTRLSA-N |
Molecular Weight |
270.460 g/mol |
SMILES |
C[C@]12CC3([C@]45C[C@@]6(C[C@@]5(C[C@@]6(C4)C)[H])C)[C@](C1)(C[C@]2(C3)C)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.809103 |