| SpectraBase Spectrum ID |
4tXjEXBAEqY |
| Name |
Dimethyl (1.alpha.,3.alpha.,3a.beta.,6.alpha.,7.beta.,8.alpha.,10a.beta.)-1,2,3,3a,6,7,8,10a-octahydro-7-(phenylthio)-1,3:6,8-ethanediylidenecyclopentacyclononene-4,10-dicarboxylate |
| CAS Registry Number |
113627-85-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H24O4S |
| InChI |
InChI=1S/C24H24O4S/c1-27-23(25)16-9-14-21-15(22(14)29-11-6-4-3-5-7-11)10-17(24(26)28-2)20-13-8-12(18(13)21)19(16)20/h3-7,9-10,12-15,18-22H,8H2,1-2H3/t12-,13+,14-,15+,18?,19-,20+,21?,22- |
| InChIKey |
XFLBHAARBKYEHW-HVGNDCNPSA-N |
| Molecular Weight |
408.512 g/mol |
| SMILES |
C=1([C@]2([C@]3(C(=C[C@]4([C@]([C@](C4C4[C@@]2(C[C@@]34[H])[H])(C1)[H])(Sc1ccccc1)[H])[H])C(=O)OC)[H])[H])C(=O)OC |
| SPLASH |
splash10-0002-3930000000-7ce312060f3c4ded5522 |
| Source of Spectrum |
C-110-3271-30 |
| Synonyms |
Dimethyl (1R,4R,6S,7R,8S,11S)-12-(phenylsulfanyl)pentacyclo[5.5.2.0(2,11).0(3,6).0(4,8)]tetradeca-9,13-diene-9,14-dicarboxylate |
| Wiley ID |
1373010 |
