CID 64369075

8-chloro-3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyrazine

Structural Information

Molecular Formula
C8H7ClN4
SMILES
C1CC1C2=NN=C3N2C=CN=C3Cl
InChI
InChI=1S/C8H7ClN4/c9-6-8-12-11-7(5-1-2-5)13(8)4-3-10-6/h3-5H,1-2H2
InChIKey
NZCRFSFETSJITG-UHFFFAOYSA-N
Compound name
8-chloro-3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.03592 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.04320 140.3
[M+Na]+ 217.02514 157.5
[M+NH4]+ 212.06974 149.6
[M+K]+ 232.99908 152.9
[M-H]- 193.02864 149.0
[M+Na-2H]- 215.01059 150.8
[M]+ 194.03537 146.6
[M]- 194.03647 146.6
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.

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No patent data available for this compound.