| SpectraBase Spectrum ID |
5KX3GhUrKkF |
| Name |
rel-(1R,2aR,8bR)-2a-Acetyl-1-(phenyl)-1,2,2a,8b-tetrahydro-3H-benzo[b]cyclobuta[d]pyran-3-one |
| Alternate Name(s) |
(1R,2aR,8bR)-2a-acetyl-1-phenyl-1,2,2a,8b-tetrahydro-3H-cyclobuta[c]chromen-3-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H16O3 |
| InChI |
InChI=1S/C19H16O3/c1-12(20)19-11-15(13-7-3-2-4-8-13)17(19)14-9-5-6-10-16(14)22-18(19)21/h2-10,15,17H,11H2,1H3/t15-,17-,19-/m0/s1 |
| InChIKey |
KNTZDDQKGVPGCA-IEZWGBDMSA-N |
| Molecular Weight |
292.334 g/mol |
| SMILES |
c12c([C@@]3([C@](C(O2)=O)(C[C@]3(c2ccccc2)[H])C(=O)C)[H])cccc1 |
| SPLASH |
splash10-0udi-0900000000-5286fa63d5b2e0c06af9 |
| Source of Spectrum |
O1-65-2422-2 |
| Wiley ID |
1593278 |
![rel-(1R,2aR,8bR)-2a-Acetyl-1-(phenyl)-1,2,2a,8b-tetrahydro-3H-benzo[b]cyclobuta[d]pyran-3-one](/api/spectrum/5KX3GhUrKkF/structure.png?h=300&w=458 "rel-(1R,2aR,8bR)-2a-Acetyl-1-(phenyl)-1,2,2a,8b-tetrahydro-3H-benzo[b]cyclobuta[d]pyran-3-one")
