| SpectraBase Spectrum ID |
9i44kgqGbvA |
| Name |
1,4:5,8-Dimethanonaphthalene, 4A-chlorodecahydro-, (1.alpha.,4.alpha.,4A.alpha.,5.beta.,8.beta.,8A.alpha.)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
196.101878247 u |
| Formula |
C12H17Cl |
| InChI |
InChI=1S/C12H17Cl/c13-12-9-3-1-7(5-9)11(12)8-2-4-10(12)6-8/h7-11H,1-6H2/t7-,8-,9+,10+,11?,12?/m0/s1 |
| InChIKey |
IKJDVOBUWRPSPM-DNVZHSBJSA-N |
| Molecular Weight |
196.721 g/mol |
| SMILES |
C12(C([C@]3([H])C[C@]2(CC3)[H])[C@]2([H])C[C@]1(CC2)[H])Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.912537 |
