SpectraBase Spectrum ID |
4pX6AWvVUDL |
Name |
1H-Naphtho[2,1-b]pyran-7-methanol, dodecahydro-7,10a-dimethyl-, 4-methylbenzenesulfonate, [4aR-(4a.alpha.,6a.beta.,7.beta.,10a.alpha.,10b.beta.)]- |
CAS Registry Number |
104915-37-9 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C23H34O4S |
InChI |
InChI=1S/C23H34O4S/c1-17-7-9-18(10-8-17)28(24,25)27-16-22(2)13-5-14-23(3)19-6-4-15-26-20(19)11-12-21(22)23/h7-10,19-21H,4-6,11-16H2,1-3H3/t19-,20+,21-,22-,23+/m0/s1 |
InChIKey |
QAFDTDCKSMSHCE-MFKCLSPESA-N |
Molecular Weight |
406.581 g/mol |
SMILES |
C(OS(c1ccc(cc1)C)(=O)=O)[C@]1([C@]2([C@]([C@]3(CCCO[C@@]3(CC2)[H])[H])(C)CCC1)[H])C |
SPLASH |
splash10-0596-9030000000-010ff9f9a4dd46ca6cf2 |
Source of Spectrum |
AH-116-1357-18 |
Synonyms |
Methyl 7,10a-dimethyl-dodecahydro-1H-naphtho[2,1-b]pyran-7-yl-p-toluensulphonate
[(4aR,6aR,7R,10aS,10bR)-7,10a-dimethyldodecahydro-1H-benzo[f]chromen-7-yl]methyl 4-methylbenzenesulfonate |
Wiley ID |
1372198 |