| SpectraBase Spectrum ID |
5uW8pxCQM4q |
| Name |
4,5,10,11-Tetramethylpentacyclo[8.2.1.1(2,5).1(4,7).1(8,11)]hexadecane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
272.250401030 u |
| Formula |
C20H32 |
| InChI |
InChI=1S/C20H32/c1-17-5-13-7-18(17,2)8-14(6-17)16-10-19(3)9-15(13)11-20(19,4)12-16/h13-16H,5-12H2,1-4H3/t13-,14+,15-,16?,17-,18+,19-,20+ |
| InChIKey |
GWOLELZZXTUQLF-GPTYZCJGSA-N |
| Molecular Weight |
272.476 g/mol |
| SMILES |
[C@]12([C@@]3(C[C@](C2)([C@@]2(C[C@]4(C)CC([C@](C1)(C3)[H])C[C@@]4(C2)C)[H])[H])C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.86236 |
![4,5,10,11-Tetramethylpentacyclo[8.2.1.1(2,5).1(4,7).1(8,11)]hexadecane](/api/spectrum/5uW8pxCQM4q/structure.png?h=300&w=458 "4,5,10,11-Tetramethylpentacyclo[8.2.1.1(2,5).1(4,7).1(8,11)]hexadecane")
