| SpectraBase Spectrum ID |
KHS461I6wxA |
| Name |
Phenanthrene, 1,2,3,4,4B,5,8,8A,9,10-decahydro-7-isopropyl-1,1,4B-trimethyl- |
| 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/c1-14(2)15-10-12-20(5)16(13-15)8-9-17-18(20)7-6-11-19(17,3)4/h10,14,16H,6-9,11-13H2,1-5H3 |
| InChIKey |
LDWBRTWZFROZNC-UHFFFAOYSA-N |
| Molecular Weight |
272.476 g/mol |
| SMILES |
CC12C3=C(C(C)(C)CCC3)CCC1CC(=CC2)C(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.903927 |
