CID 155978258

1-{[1,2,4]triazolo[4,3-a]pyrazin-6-yl}methanamine dihydrochloride

Structural Information

Molecular Formula
C6H7N5
SMILES
C1=C(N=CC2=NN=CN21)CN
InChI
InChI=1S/C6H7N5/c7-1-5-3-11-4-9-10-6(11)2-8-5/h2-4H,1,7H2
InChIKey
OQPIMMJZXHBSMU-UHFFFAOYSA-N
Compound name
[1,2,4]triazolo[4,3-a]pyrazin-6-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

149.07014 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.07742 126.5
[M+Na]+ 172.05936 139.8
[M+NH4]+ 167.10396 134.2
[M+K]+ 188.03330 136.0
[M-H]- 148.06286 127.1
[M+Na-2H]- 170.04481 133.8
[M]+ 149.06959 128.4
[M]- 149.07069 128.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

Patent stripe

No patent data available for this compound.