SpectraBase Spectrum ID |
L9Ugh7Ou76t |
Name |
5,2,9-Ethanylylidene-1-benzoxepin-11-one, decahydro-6-[[(4-methylphenyl)sulfonyl]oxy]-, (2.alpha.,5.alpha.,5a.beta.,6.beta.,9.alpha.,9a.beta.,10R*)- |
CAS Registry Number |
83098-73-1 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C19H22O5S |
InChI |
InChI=1S/C19H22O5S/c1-10-2-4-11(5-3-10)25(21,22)24-15-9-7-13-12-6-8-14-16(18(12)20)17(15)19(13)23-14/h2-5,12-17,19H,6-9H2,1H3/t12-,13-,14-,15?,16+,17+,19+/m1/s1 |
InChIKey |
VYSQSXIDAZUFDH-VKVWYINVSA-N |
Molecular Weight |
362.440 g/mol |
SMILES |
C1(OS(c2ccc(cc2)C)(=O)=O)[C@]2([C@]3(C(=O)[C@]4([C@@](CC1)([C@@]2(O[C@@]3(CC4)[H])[H])[H])[H])[H])[H] |
SPLASH |
splash10-0006-9600000000-8877044aa2ef1c743508 |
Source of Spectrum |
H-65-1014-0 |
Synonyms |
2-Oxo-10-oxatetracyclo[6.5.0.0(3,11).0(4,9)]tridec-5-yl 4-methylbenzenesulfonate
[2-oxo-10-oxatetracyclo[6.5.0.0(3,11).0(4,9)]tridec-5exo-yl]ester of p-toluolsulfonoic acid |
Wiley ID |
1349483 |