CID 135481894

1-(1-naphthyl)-2-amino-2-imidazoline sulfate

Structural Information

Molecular Formula
C13H14N3
SMILES
C1C[N+](=C(N1)N)C2=CC=CC3=CC=CC=C32
InChI
InChI=1S/C13H13N3/c14-13-15-8-9-16(13)12-7-3-5-10-4-1-2-6-11(10)12/h1-7H,8-9H2,(H2,14,15)/p+1
InChIKey
IZBBZZGIVOUMSG-UHFFFAOYSA-O
Compound name
3-naphthalen-1-yl-4,5-dihydro-1H-imidazol-3-ium-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

212.11877 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.12605 146.9
[M+Na]+ 235.10799 154.7
[M-H]- 211.11149 150.6
[M+NH4]+ 230.15259 164.2
[M+K]+ 251.08193 143.6
[M+H-H2O]+ 195.11603 141.4
[M+HCOO]- 257.11697 166.8
[M+CH3COO]- 271.13262 179.4
[M+Na-2H]- 233.09344 155.0
[M]+ 212.11822 141.0
[M]- 212.11932 141.0
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.