| SpectraBase Spectrum ID |
LCy79FmOSZy |
| Name |
(1S,3R,5RS,7R,8R)-5-phenyl-10-oxo-4,6,9-trioxatricyclo[6.2.1(1,8).0(3,7)]undecan-1-ol |
| Alternate Name(s) |
(1R,2R,6R,8S)-8-hydroxy-4-phenyl-3,5,10-trioxatricyclo[6.2.1.0(2,6)]undecan-9-one |
| CAS Registry Number |
94903-42-1 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H14O5 |
| InChI |
InChI=1S/C14H14O5/c15-13-14(16)6-9-11(10(7-14)18-13)19-12(17-9)8-4-2-1-3-5-8/h1-5,9-12,16H,6-7H2/t9-,10+,11+,12?,14-/m0/s1 |
| InChIKey |
CABHUIHIQVPQJH-PNSFIKPISA-N |
| Molecular Weight |
262.261 g/mol |
| SMILES |
O[C@]12C(O[C@@]([C@@]3(OC(O[C@]3(C2)[H])c2ccccc2)[H])(C1)[H])=O |
| SPLASH |
splash10-03di-0090000000-dcdd34caaabec42ce307 |
| Source of Spectrum |
J-50-889-4 |
| Wiley ID |
1265671 |
![(1S,3R,5RS,7R,8R)-5-phenyl-10-oxo-4,6,9-trioxatricyclo[6.2.1(1,8).0(3,7)]undecan-1-ol](/api/spectrum/LCy79FmOSZy/structure.png?h=300&w=458 "(1S,3R,5RS,7R,8R)-5-phenyl-10-oxo-4,6,9-trioxatricyclo[6.2.1(1,8).0(3,7)]undecan-1-ol")
