CID 55150

83823-10-3

Structural Information

Molecular Formula
C18H17NO2
SMILES
C1C(=CC2=CC=CC=C2O1)C(=O)NCCC3=CC=CC=C3
InChI
InChI=1S/C18H17NO2/c20-18(19-11-10-14-6-2-1-3-7-14)16-12-15-8-4-5-9-17(15)21-13-16/h1-9,12H,10-11,13H2,(H,19,20)
InChIKey
DFFJXEMYKJFSGW-UHFFFAOYSA-N
Compound name
N-(2-phenylethyl)-2H-chromene-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

279.12592 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.13320 165.5
[M+Na]+ 302.11514 180.1
[M+NH4]+ 297.15974 174.7
[M+K]+ 318.08908 171.5
[M-H]- 278.11864 172.7
[M+Na-2H]- 300.10059 174.4
[M]+ 279.12537 169.8
[M]- 279.12647 169.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.