Stereochemistry | EPIMERIC |
Molecular Formula | C13H18O3 |
Molecular Weight | 222.2802 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(CO)CC1=CC=C(C=C1)[C@H](C)C(O)=O
InChI
InChIKey=HFAIHLSDLUYLQA-AXDSSHIGSA-N
InChI=1S/C13H18O3/c1-9(8-14)7-11-3-5-12(6-4-11)10(2)13(15)16/h3-6,9-10,14H,7-8H2,1-2H3,(H,15,16)/t9?,10-/m0/s1
Molecular Formula | C13H18O3 |
Molecular Weight | 222.2802 |
Charge | 0 |
Count |
MOL RATIO
1 MOL RATIO (average) |
Stereochemistry | EPIMERIC |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |