| SpectraBase Spectrum ID |
JhAToGrLXNd |
| Name |
1-Naphthalenol, 5-bromo-1,2,3,4,4A,5,6,8A-octahydro-4A,8-dimethyl-2-(1-methylethyl)-, acetate, [1R-(1.alpha.,2.beta.,4A.alpha.,5.alpha., 8A.alpha.)]- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
342.119443107 u |
| Formula |
C17H27BrO2 |
| InChI |
InChI=1S/C17H27BrO2/c1-10(2)13-8-9-17(5)14(18)7-6-11(3)15(17)16(13)20-12(4)19/h6,10,13-16H,7-9H2,1-5H3/t13-,14-,15+,16-,17+/m1/s1 |
| InChIKey |
VMIMSNIRZNONQQ-UUAJXVIYSA-N |
| Molecular Weight |
343.305 g/mol |
| SMILES |
[C@]1([C@]2([C@@]([C@](Br)(CC=C2C)[H])(C)CC[C@@]1(C(C)C)[H])[H])(OC(=O)C)[H] |
![1-Naphthalenol, 5-bromo-1,2,3,4,4a,5,6,8a-octahydro-4a,8-dimethyl-2-(1-methylethyl)-, acetate, [1R-(1.alpha.,2.beta.,4a.alpha.,5.alpha., 8a.alpha.)]-](/api/spectrum/JhAToGrLXNd/structure.png?h=300&w=458 "1-Naphthalenol, 5-bromo-1,2,3,4,4a,5,6,8a-octahydro-4a,8-dimethyl-2-(1-methylethyl)-, acetate, [1R-(1.alpha.,2.beta.,4a.alpha.,5.alpha., 8a.alpha.)]-")
