| SpectraBase Spectrum ID |
K99JXd1qzez |
| Name |
(1R*,4R*,5S*)-4-(Methoxycarbonyl)-4-methyl-1-[(phenylsulfonyl)methyl]-8-oxabicyclo[3.2.1]octan-3-one,Ethylene Acetal |
| Alternate Name(s) |
methyl (1R,4R,5S)-1-[(benzenesulfonyl)methyl]-4-methyl-8-oxaspiro[bicyclo[3.2.1]octane-3,2'-[1,3]dioxolane]-4-carboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H24O7S |
| InChI |
InChI=1S/C19H24O7S/c1-17(16(20)23-2)15-8-9-18(26-15,12-19(17)24-10-11-25-19)13-27(21,22)14-6-4-3-5-7-14/h3-7,15H,8-13H2,1-2H3/t15-,17-,18+/m0/s1 |
| InChIKey |
ADNFCDFOJLJLCQ-RYQLBKOJSA-N |
| Molecular Weight |
396.454 g/mol |
| SMILES |
C12([C@@]([C@@]3(CC[C@@](C2)(CS(=O)(=O)c2ccccc2)O3)[H])(C(=O)OC)C)OCCO1 |
| SPLASH |
splash10-0006-0091000000-348c4ef056281a7a8e77 |
| Source of Spectrum |
J-60-8392-15 |
| Wiley ID |
1367334 |
![(1R*,4R*,5S*)-4-(Methoxycarbonyl)-4-methyl-1-[(phenylsulfonyl)methyl]-8-oxabicyclo[3.2.1]octan-3-one,Ethylene Acetal](/api/spectrum/K99JXd1qzez/structure.png?h=300&w=458 "(1R*,4R*,5S*)-4-(Methoxycarbonyl)-4-methyl-1-[(phenylsulfonyl)methyl]-8-oxabicyclo[3.2.1]octan-3-one,Ethylene Acetal")
