| SpectraBase Spectrum ID |
K5sefqe58rT |
| Name |
(3aS,7aS)-6-Bromo-7a-(4-methoxyphenyl)-2-tosyl-2,3,3a,4,5,7a-hexahydro-1H-isoindole |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H24BrNO3S |
| InChI |
InChI=1S/C22H24BrNO3S/c1-16-3-11-21(12-4-16)28(25,26)24-14-18-5-8-19(23)13-22(18,15-24)17-6-9-20(27-2)10-7-17/h3-4,6-7,9-13,18H,5,8,14-15H2,1-2H3/t18-,22+/m1/s1 |
| InChIKey |
TUGZRMTYEPHCRL-GCJKJVERSA-N |
| Molecular Weight |
462.402 g/mol |
| SMILES |
[C@]12([C@@](CN(C2)S(=O)(=O)c2ccc(C)cc2)(c2ccc(OC)cc2)C=C(Br)CC1)[H] |
| SPLASH |
splash10-052b-0925100000-b3ac7ec36dbf6c5d8c13 |
| Source of Spectrum |
J-80-2466-4e |
| Wiley ID |
1801863 |
