CID 2200

Antazoline

Structural Information

Molecular Formula
C17H19N3
SMILES
C1CN=C(N1)CN(CC2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C17H19N3/c1-3-7-15(8-4-1)13-20(14-17-18-11-12-19-17)16-9-5-2-6-10-16/h1-10H,11-14H2,(H,18,19)
InChIKey
REYFJDPCWQRWAA-UHFFFAOYSA-N
Compound name
N-benzyl-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)aniline
Related CIDs

2D Structure

compound 2d structure
8
Annotation Hits

261
References

11488
Patents

265.1579 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.16518 164.0
[M+Na]+ 288.14712 177.3
[M+NH4]+ 283.19172 172.7
[M+K]+ 304.12106 170.6
[M-H]- 264.15062 170.0
[M+Na-2H]- 286.13257 174.8
[M]+ 265.15735 167.6
[M]- 265.15845 167.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe