SpectraBase Spectrum ID |
KzwZM9PkiFW |
Name |
dl-(1.alpha.,2.alpha.,4.alpha.,5.beta.,6.alpha.,7.alpha.)-6-bromo-3-(phenylsulfonyl)-8-oxa-3-azatricyclo[5.1.0.0(2,4)]octan-5-ol |
Alternate Name(s) |
(1S,2S,4S,5S,6R,7R)-5-bromo-8-(phenylsulfonyl)-3-oxa-8-azatricyclo[5.1.0.0(2,4)]octan-6-ol |
CAS Registry Number |
112346-57-3 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C12H12BrNO4S |
InChI |
InChI=1S/C12H12BrNO4S/c13-7-10(15)8-9(12-11(7)18-12)14(8)19(16,17)6-4-2-1-3-5-6/h1-5,7-12,15H/t7-,8+,9-,10-,11+,12-,14?/m0/s1 |
InChIKey |
ZXLYOYQPJSQCJB-IWADGLSKSA-N |
Molecular Weight |
346.195 g/mol |
SMILES |
O[C@@]1([C@@]2(N([C@@]2([C@]2([C@@]([H])([C@]1(Br)[H])O2)[H])[H])S(=O)(=O)c1ccccc1)[H])[H] |
SPLASH |
splash10-00kf-0915000000-80f34d7487af7eeffd53 |
Source of Spectrum |
K-121-768-18 |
Wiley ID |
1338463 |