| SpectraBase Spectrum ID |
3jsfAr7zVQX |
| Name |
3,3-Dimethoxy-7-methoxycarbonyl-7-methyl-5-(2,5-dioxacyclopentyl)bicyclo[2.2.2]oct-5-en-2-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H22O7 |
| InChI |
InChI=1S/C16H22O7/c1-15(14(18)19-2)8-11-9(13-22-5-6-23-13)7-10(15)12(17)16(11,20-3)21-4/h7,10-11,13H,5-6,8H2,1-4H3/t10-,11+,15-/m1/s1 |
| InChIKey |
TYMCLZZRQVEOJW-JRPNMDOOSA-N |
| Molecular Weight |
326.345 g/mol |
| SMILES |
C1([C@@]2(C(C3OCCO3)=C[C@](C1=O)([C@@](C(=O)OC)(C)C2)[H])[H])(OC)OC |
| SPLASH |
splash10-014j-0090000000-f69ea9e30f33411c03fb |
| Source of Spectrum |
J-64-4110-21 |
| Synonyms |
(1R*,4S*,7S*)-3,3-Dimethoxy-7-methoxycarbonyl-7-methyl-5-(2,5-dioxacyclopentyl)bicyclo[2.2.2]oct-5-en-2-one
methyl 5-(1,3-dioxolan-2-yl)-8,8-dimethoxy-2-methyl-7-oxobicyclo[2.2.2]oct-5-ene-2-carboxylate |
| Wiley ID |
1530304 |
![3,3-Dimethoxy-7-methoxycarbonyl-7-methyl-5-(2,5-dioxacyclopentyl)bicyclo[2.2.2]oct-5-en-2-one](/api/spectrum/3jsfAr7zVQX/structure.png?h=300&w=458 "3,3-Dimethoxy-7-methoxycarbonyl-7-methyl-5-(2,5-dioxacyclopentyl)bicyclo[2.2.2]oct-5-en-2-one")
