CID 55265594

405162-62-1

Structural Information

Molecular Formula
C7H9N3
SMILES
C1CNCC2=NC=CN=C21
InChI
InChI=1S/C7H9N3/c1-2-8-5-7-6(1)9-3-4-10-7/h3-4,8H,1-2,5H2
InChIKey
XPONSZGOXQPNGL-UHFFFAOYSA-N
Compound name
5,6,7,8-tetrahydropyrido[3,4-b]pyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

199
Patents

135.07965 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 136.08693 126.9
[M+Na]+ 158.06887 134.3
[M-H]- 134.07237 125.3
[M+NH4]+ 153.11347 144.7
[M+K]+ 174.04281 131.0
[M+H-H2O]+ 118.07691 119.0
[M+HCOO]- 180.07785 143.7
[M+CH3COO]- 194.09350 138.8
[M+Na-2H]- 156.05432 137.0
[M]+ 135.07910 121.7
[M]- 135.08020 121.7
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.