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: C9H14O3
- Molecular weight: 170.2057
- IUPAC Standard InChI:
- InChI=1S/C9H14O3/c1-3-4-5-6-7-12-9(11)8(2)10/h4-5H,3,6-7H2,1-2H3/b5-4-
- IUPAC Standard InChIKey: LKNXTZXOBHAYSR-PLNGDYQASA-N
- Connectivity:
- 2-d Mol File from the identifier
- Canonical atom numbers:
Note: stereochemistry is currently not indicated in the items above.
Contents of the identifier
Identifier version: 1S
Main section
- Formula: C9H14O3
- Connectivity: 1-3-4-5-6-7-12-9(11)8(2)10
- Hydrogen: 4-5H,3,6-7H2,1-2H3
- Double bond stereo: 5-4-