CID 20866

4751-46-6

Structural Information

Molecular Formula

C₁₃H₁₃N₃

SMILES

C1CN=C(N1)NC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C13H13N3/c1-2-6-11-10(4-1)5-3-7-12(11)16-13-14-8-9-15-13/h1-7H,8-9H2,(H2,14,15,16)

InChIKey

CVSIGGCDCSNCSY-UHFFFAOYSA-N

Compound name

N-naphthalen-1-yl-4,5-dihydro-1H-imidazol-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 75
Patents: 211.11095 Da
Monoisotopic Mass: 1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	212.11823	146.9
[M+Na]+	234.10017	160.3
[M+NH4]+	229.14477	156.2
[M+K]+	250.07411	154.2
[M-H]-	210.10367	151.2
[M+Na-2H]-	232.08562	155.5
[M]+	211.11040	150.0
[M]-	211.11150	150.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe