Information from the InChI
There are no matching entries in the database for this IUPAC International Chemical Identifier. The following information was obtained from the identifier.
- Formula: C12H22O2·C4H6O2·C4H6O2
- Molecular weight: 370.4804
- IUPAC Standard InChI:
- InChI=1S/C12H22O2.2C4H6O2/c1-3-5-6-7-8-9-10-11-12(13)14-4-2;1-3-6-4(2)5;1-2-3-4(5)6/h4H,2-3,5-11H2,1H3;3H,1H2,2H3;2-3H,1H3,(H,5,6)/b;;3-2
- IUPAC Standard InChIKey: VAIIXUHTYBJVBX-MWIJDQDESA-N
- Connectivity:
- 2-d Mol File from the identifier
- Canonical atom numbers:
Note: stereochemistry is currently not indicated in the items above. - Permanent link for this search. Use this link for bookmarking this species for future reference.
Contents of the identifier
Identifier version: 1
Main section
- Formula: C12H22O2.2C4H6O2
- Connectivity: 1-3-5-6-7-8-9-10-11-12(13)14-4-2;1-3-6-4(2)5;1-2-3-4(5)6
- Hydrogen: 4H,2-3,5-11H2,1H3;3H,1H2,2H3;2-3H,1H3,(H,5,6)
- Double bond stereo: ;;3-2