SpectraBase Spectrum ID |
CP9EXcL6RDq |
Name |
Hexamethyl-tricyclo[3.2.0.0(2,4)]hept-6-ene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
176.156500644 u |
Formula |
C13H20 |
InChI |
InChI=1S/C13H20/c1-8-9(2)13(6)11(4)7-10(11,3)12(8,13)5/h7H2,1-6H3/t10-,11-,12-,13-/m0/s1 |
InChIKey |
VIQPDNPICQYDMZ-CYDGBPFRSA-N |
Molecular Weight |
176.303 g/mol |
SMILES |
[C@@]12([C@](C)(C2)[C@]2([C@]1(C(C)=C2C)C)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.945823 |