| SpectraBase Spectrum ID |
BLvTD6KtKEp |
| Name |
(1RS,5SR,6SR)-5-Bromo-7-oxabicyclo[4.3.0]nonan-8-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C8H11BrO2 |
| InChI |
InChI=1S/C8H11BrO2/c9-6-3-1-2-5-4-7(10)11-8(5)6/h5-6,8H,1-4H2/t5-,6+,8+/m0/s1 |
| InChIKey |
CPJOVXXSCQIBMX-SHYZEUOFSA-N |
| Molecular Weight |
219.078 g/mol |
| SMILES |
C1(O[C@@]2([C@](C1)(CCC[C@]2(Br)[H])[H])[H])=O |
| SPLASH |
splash10-0002-9070000000-5add9f811c5f44584c67 |
| Source of Spectrum |
KC-0-850-12 |
| Synonyms |
(3aS,7R,7aR)-7-Bromo-hexahydro-benzofuran-2-one
7-bromohexahydro-1-benzofuran-2(3H)-one |
| Wiley ID |
780936 |
![(1RS,5SR,6SR)-5-Bromo-7-oxabicyclo[4.3.0]nonan-8-one](/api/spectrum/BLvTD6KtKEp/structure.png?h=300&w=458 "(1RS,5SR,6SR)-5-Bromo-7-oxabicyclo[4.3.0]nonan-8-one")
