| SpectraBase Spectrum ID |
5lVy8leKhCE |
| Name |
rel-(1R,2aS,8bS)-2a-Benzoyl-1-phenyl-1,2,2a,8b-tetrahydro-3H-benzo[b]cyclobuta[d]pyran-3-one |
| Alternate Name(s) |
(1R,2aS,8bS)-2a-benzoyl-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 |
C24H18O3 |
| InChI |
InChI=1S/C24H18O3/c25-22(17-11-5-2-6-12-17)24-15-19(16-9-3-1-4-10-16)21(24)18-13-7-8-14-20(18)27-23(24)26/h1-14,19,21H,15H2/t19-,21+,24-/m0/s1 |
| InChIKey |
YBUQXRTVVSHLHZ-LEEZEASISA-N |
| Molecular Weight |
354.405 g/mol |
| SMILES |
c12c([C@]3([C@@](C(O2)=O)(C[C@]3(c2ccccc2)[H])C(c2ccccc2)=O)[H])cccc1 |
| SPLASH |
splash10-0udi-0900000000-d24cd29af35c275900b1 |
| Source of Spectrum |
O1-65-2418-3 |
| Wiley ID |
1593287 |
![rel-(1R,2aS,8bS)-2a-Benzoyl-1-phenyl-1,2,2a,8b-tetrahydro-3H-benzo[b]cyclobuta[d]pyran-3-one](/api/spectrum/5lVy8leKhCE/structure.png?h=300&w=458 "rel-(1R,2aS,8bS)-2a-Benzoyl-1-phenyl-1,2,2a,8b-tetrahydro-3H-benzo[b]cyclobuta[d]pyran-3-one")
