| Stereochemistry | ACHIRAL |
| Molecular Formula | C7H8O3.C6H15N |
| Molecular Weight | 241.3266 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C)NC(C)C.OC(=O)\C=C1/CCCC1=O
InChI
InChIKey=OXSTVDGSFYEIGL-FXRZFVDSSA-N
InChI=1S/C7H8O3.C6H15N/c8-6-3-1-2-5(6)4-7(9)10;1-5(2)7-6(3)4/h4H,1-3H2,(H,9,10);5-7H,1-4H3/b5-4+;
| Molecular Formula | C6H15N |
| Molecular Weight | 101.19 |
| Charge | 0 |
| Count |
MOL RATIO
1 MOL RATIO (average) |
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C7H8O3 |
| Molecular Weight | 140.1366 |
| Charge | 0 |
| Count |
MOL RATIO
1 MOL RATIO (average) |
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Optical Activity | NONE |
