| SpectraBase Spectrum ID |
KvLB0gcqzyv |
| Name |
(1S,2R,4R,8S)-2-formyl-2,4-dimethoxy-3-oxo-8-bicyclo[2.2.2]oct-5-enecarboxylic acid ethyl ester |
| Alternate Name(s) |
(1S,2R,4R,8S)-2-formyl-3-keto-2,4-dimethoxy-bicyclo[2.2.2]oct-5-ene-8-carboxylic acid ethyl ester
ethyl (1S,2R,4R,8S)-2-formyl-2,4-dimethoxy-3-oxo-bicyclo[2.2.2]oct-5-ene-8-carboxylate
ethyl (1S,2R,4R,8S)-2-methanoyl-2,4-dimethoxy-3-oxidanylidene-bicyclo[2.2.2]oct-5-ene-8-carboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H18O6 |
| InChI |
InChI=1S/C14H18O6/c1-4-20-11(16)10-7-9-5-6-13(10,18-2)12(17)14(9,8-15)19-3/h5-6,8-10H,4,7H2,1-3H3/t9-,10-,13-,14+/m1/s1 |
| InChIKey |
QDUJKGJOMRCOIR-MHWZDGSBSA-N |
| Molecular Weight |
282.292 g/mol |
| SMILES |
[C@]12(C([C@@](C=O)(OC)[C@](C=C2)(C[C@@]1(C(=O)OCC)[H])[H])=O)OC |
| SPLASH |
splash10-0udi-0090000000-268b08bb777f1df51d1e |
| Source of Spectrum |
KC-0-569-20 |
| Wiley ID |
787493 |
![(1S,2R,4R,8S)-2-formyl-2,4-dimethoxy-3-oxo-8-bicyclo[2.2.2]oct-5-enecarboxylic acid ethyl ester](/api/spectrum/KvLB0gcqzyv/structure.png?h=300&w=458 "(1S,2R,4R,8S)-2-formyl-2,4-dimethoxy-3-oxo-8-bicyclo[2.2.2]oct-5-enecarboxylic acid ethyl ester")
