CID 36136

32421-56-0

Structural Information

Molecular Formula
C21H19N3O
SMILES
C1CN=C(N1)CN(C2=CC=CC=C2)C(=O)C3=CC=CC4=CC=CC=C43
InChI
InChI=1S/C21H19N3O/c25-21(19-12-6-8-16-7-4-5-11-18(16)19)24(15-20-22-13-14-23-20)17-9-2-1-3-10-17/h1-12H,13-15H2,(H,22,23)
InChIKey
NRJIXIBPYXAQHK-UHFFFAOYSA-N
Compound name
N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-N-phenylnaphthalene-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

329.1528 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.16008 177.1
[M+Na]+ 352.14202 181.7
[M-H]- 328.14552 184.4
[M+NH4]+ 347.18662 189.4
[M+K]+ 368.11596 175.8
[M+H-H2O]+ 312.15006 166.3
[M+HCOO]- 374.15100 196.2
[M+CH3COO]- 388.16665 186.5
[M+Na-2H]- 350.12747 180.7
[M]+ 329.15225 174.1
[M]- 329.15335 174.1
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

patents stripe