| SpectraBase Spectrum ID |
J3LqB9dr9hG |
| Name |
(+-)-(1.alpha.,5.alpha.,6.alpha.)-5-Hydroxy-7-oxabicyclo[4.1.0]hept-3-en-2-one |
| Alternate Name(s) |
(+,-)-(1a,5a,6a)-5-hydroxy-7-oxabicyclo[4.1.0]hept-3-en-2-one
(1R,5S,6R)-5-hydroxy-7-oxabicyclo[4.1.0]hept-3-en-2-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C6H6O3 |
| InChI |
InChI=1S/C6H6O3/c7-3-1-2-4(8)6-5(3)9-6/h1-3,5-7H/t3-,5+,6-/m0/s1 |
| InChIKey |
HHEPZGQHWOPVMS-LFRDXLMFSA-N |
| Molecular Weight |
126.111 g/mol |
| SMILES |
O[C@@]1([C@@]2([C@@](O2)(C(C=C1)=O)[H])[H])[H] |
| SPLASH |
splash10-0002-9100000000-49aff228b4b0551b6338 |
| Source of Spectrum |
B-44-61-0 |
| Wiley ID |
1129732 |
![5-HYDROXY-7-OXABICYClO-[4.1.0(1,6)]-HEPT-3-ENE-2-ONE](/api/spectrum/J3LqB9dr9hG/structure.png?h=300&w=458 "5-HYDROXY-7-OXABICYClO-[4.1.0(1,6)]-HEPT-3-ENE-2-ONE")
