CID 42609129

1184918-13-5

Structural Information

Molecular Formula
C7H8N4
SMILES
C1CC1N2C(=C(C=N2)C#N)N
InChI
InChI=1S/C7H8N4/c8-3-5-4-10-11(7(5)9)6-1-2-6/h4,6H,1-2,9H2
InChIKey
FFRVJMPRRCRKNL-UHFFFAOYSA-N
Compound name
5-amino-1-cyclopropylpyrazole-4-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

148.07489 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.082166 128.7
[M+Na]+ 171.064108 144.9
[M-H]- 147.067614 134.2
[M+NH4]+ 166.108713 143.9
[M+K]+ 187.038048 138.2
[M+H-H2O]+ 131.072150 117.2
[M+HCOO]- 193.073091 150.6
[M+CH3COO]- 207.088741 142.3
[M+Na-2H]- 169.049556 135.1
[M]+ 148.07434142 126.2
[M]- 148.07543858 126.2
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

patents stripe