CID 3038958

Brn 0554724

Structural Information

Molecular Formula
C15H19N5
SMILES
C1CN2CC3=C(CC2CN1C(=N)N)C4=CC=CC=C4N3
InChI
InChI=1S/C15H19N5/c16-15(17)20-6-5-19-9-14-12(7-10(19)8-20)11-3-1-2-4-13(11)18-14/h1-4,10,18H,5-9H2,(H3,16,17)
InChIKey
HFKRIRGEQNBVBC-UHFFFAOYSA-N
Compound name
3,6,17-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),11,13,15-tetraene-6-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

269.16403 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.17131 161.3
[M+Na]+ 292.15325 171.9
[M+NH4]+ 287.19785 169.5
[M+K]+ 308.12719 167.3
[M-H]- 268.15675 163.5
[M+Na-2H]- 290.13870 164.1
[M]+ 269.16348 163.0
[M]- 269.16458 163.0
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.