CID 2807044

Ns00016283

Structural Information

Molecular Formula
C12H14N4
SMILES
C1CC(=NNC2=NCCN2)C3=CC=CC=C31
InChI
InChI=1S/C12H14N4/c1-2-4-10-9(3-1)5-6-11(10)15-16-12-13-7-8-14-12/h1-4H,5-8H2,(H2,13,14,16)
InChIKey
FHHGDCBOLMMRRT-UHFFFAOYSA-N
Compound name
N-(2,3-dihydroinden-1-ylideneamino)-4,5-dihydro-1H-imidazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

214.12184 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.129116 144.7
[M+Na]+ 237.111058 151.0
[M-H]- 213.114564 149.6
[M+NH4]+ 232.155663 164.3
[M+K]+ 253.084998 147.0
[M+H-H2O]+ 197.119100 136.2
[M+HCOO]- 259.120041 168.1
[M+CH3COO]- 273.135691 156.8
[M+Na-2H]- 235.096506 150.0
[M]+ 214.12129142 140.1
[M]- 214.12238858 140.1
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

No patent data available for this compound.