This information is based on the molecular structure shown on the left side. For a decoupled sample, please refer to its individual details.
Formula: C18H15NO2
Canonical SMILES:
C#CCNC(=O)OCC1c2ccccc2-c2c1cccc2
InChI:
InChI=1S/C18H15NO2/c1-2-11-19-18(20)21-12-17-15-9-5-3-7-13(15)14-8-4-6-10-16(14)17/h1,3-10,17H,11-12H2,(H,19,20)
InChIKey:
WVWNQUIGNHTEJW-UHFFFAOYSA-N
Exact Mass:
Crosslinks: 