SpectraBase Spectrum ID |
GFXD5iN571G |
Name |
2,4-Dithiabicyclo[3.2.1]octan-6-ol, 3-(4-methoxyphenyl)-7-propyl-, (3-exo,6-exo,7-endo)-(.+-.)- |
CAS Registry Number |
106470-19-3 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H22O2S2 |
InChI |
InChI=1S/C16H22O2S2/c1-3-4-12-13-9-14(15(12)17)20-16(19-13)10-5-7-11(18-2)8-6-10/h5-8,12-17H,3-4,9H2,1-2H3/t12?,13-,14+,15+,16-/m0/s1 |
InChIKey |
XGJOXVCORHOQPW-GZPFGDLZSA-N |
Molecular Weight |
310.470 g/mol |
SMILES |
O[C@@]1(C([C@]2(S[C@@](S[C@]1([H])C2)(c1ccc(cc1)OC)[H])[H])CCC)[H] |
SPLASH |
splash10-0uk9-0901000000-a65fcfdc0fbfa180105c |
Source of Spectrum |
J-52-870-9 |
Synonyms |
(1S,3S,5R,6R)-3-(4-methoxyphenyl)-7-propyl-2,4-dithiabicyclo[3.2.1]octan-6-ol
(1SR,3SR,5RS,6RS,7RS)-6-hydroxy-3-(4-methoxy-phenyl)-7-propyl-2,4-dithiabicyclo[3.2.1]octane |
Wiley ID |
1311380 |