CID 6450956

121845-70-3

Structural Information

Molecular Formula
C13H15N5
SMILES
C1CCN(CC1)/C=C/C2=NC3=C(C=CN=C3)N=N2
InChI
InChI=1S/C13H15N5/c1-2-7-18(8-3-1)9-5-13-15-12-10-14-6-4-11(12)16-17-13/h4-6,9-10H,1-3,7-8H2/b9-5+
InChIKey
FVFLEPQOOUXUQA-WEVVVXLNSA-N
Compound name
3-[(E)-2-piperidin-1-ylethenyl]pyrido[3,4-e][1,2,4]triazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

241.13275 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.14003 158.8
[M+Na]+ 264.12197 165.5
[M-H]- 240.12547 158.1
[M+NH4]+ 259.16657 169.6
[M+K]+ 280.09591 159.6
[M+H-H2O]+ 224.13001 146.7
[M+HCOO]- 286.13095 172.1
[M+CH3COO]- 300.14660 167.7
[M+Na-2H]- 262.10742 166.4
[M]+ 241.13220 153.8
[M]- 241.13330 153.8
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.