| SpectraBase Spectrum ID |
B0oXrKc3mmO |
| Name |
1(2H)-Naphthalenone, 4-bromooctahydro-, (4.alpha.,4a.alpha.,8a.beta.)- |
| Alternate Name(s) |
(1S,5S,6S)*-5-Bromobicyclo[4.4.0]decan-2-one
(4S,4aS,8aS)-4-bromooctahydro-1(2H)-naphthalenone |
| CAS Registry Number |
134080-39-0 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H15BrO |
| InChI |
InChI=1S/C10H15BrO/c11-9-5-6-10(12)8-4-2-1-3-7(8)9/h7-9H,1-6H2/t7-,8-,9-/m0/s1 |
| InChIKey |
CLOIHANKXGLKAV-CIUDSAMLSA-N |
| Molecular Weight |
231.133 g/mol |
| SMILES |
[C@]12([C@@]([C@@](Br)(CCC2=O)[H])(CCCC1)[H])[H] |
| SPLASH |
splash10-0f89-0590000000-3e24d527894a91929f09 |
| Source of Spectrum |
C-113-5026-7 |
| Wiley ID |
1231321 |
