| SpectraBase Spectrum ID |
GM2sv9zHbhH |
| Name |
(1S,4S,7R) 1-(t-Butylmethyl)-2-oxo-4-methyl-7-[(phenylthio)methyl]-3-oxabicyclo[4.3.0(4,9)]nonane |
| Alternate Name(s) |
(3S,3aS,5S,7aS)-7a-methyl-3-neopentyl-5-[(phenylsulfanyl)methyl]hexahydro-1-benzofuran-2(3H)-one
1-(t-Butylmethyl)-2-oxo-4-allyl-7-[(phenylthio)methyl]-3-oxabicyclo[4.3.0(4,9)]nonane |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H30O2S |
| InChI |
InChI=1S/C21H30O2S/c1-20(2,3)13-17-18-12-15(10-11-21(18,4)23-19(17)22)14-24-16-8-6-5-7-9-16/h5-9,15,17-18H,10-14H2,1-4H3/t15-,17-,18-,21-/m0/s1 |
| InChIKey |
VOKGWFLQXPMJRL-DBSRCYSRSA-N |
| Molecular Weight |
346.529 g/mol |
| SMILES |
C1(O[C@]2(CC[C@@](C[C@]2([C@@]1(CC(C)(C)C)[H])[H])(CSc1ccccc1)[H])C)=O |
| SPLASH |
splash10-06r2-5519000000-415399442e723e098670 |
| Source of Spectrum |
D1-1996-700-5 |
| Wiley ID |
834745 |
![(1S,4S,7R) 1-(t-Butylmethyl)-2-oxo-4-methyl-7-[(phenylthio)methyl]-3-oxabicyclo[4.3.0(4,9)]nonane](/api/spectrum/GM2sv9zHbhH/structure.png?h=300&w=458 "(1S,4S,7R) 1-(t-Butylmethyl)-2-oxo-4-methyl-7-[(phenylthio)methyl]-3-oxabicyclo[4.3.0(4,9)]nonane")
