| SpectraBase Spectrum ID |
E7Ei0CbWYue |
| Name |
(4ar,6R,8as)-5-[(E)-2-Chloroethenyl]decahydro-1,1,4A,6-tetramethylnaphthalene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
254.180128569 u |
| Formula |
C16H27Cl |
| InChI |
InChI=1S/C16H27Cl/c1-12-6-7-14-15(2,3)9-5-10-16(14,4)13(12)8-11-17/h8,11-14H,5-7,9-10H2,1-4H3/b11-8+/t12-,13?,14+,16-/m1/s1 |
| InChIKey |
AGFUIXLRMYNYKF-NZDDONRBSA-N |
| Molecular Weight |
254.845 g/mol |
| SMILES |
C1([C@@](CC[C@]2(C(CCC[C@]12C)(C)C)[H])(C)[H])\C=C\Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.924187 |
![(4aR,6R,8aS)-5-[(E)-2-chloroethenyl]decahydro-1,1,4a,6-tetramethylnaphthalene](/api/spectrum/E7Ei0CbWYue/structure.png?h=300&w=458 "(4aR,6R,8aS)-5-[(E)-2-chloroethenyl]decahydro-1,1,4a,6-tetramethylnaphthalene")
