CID 54592898

1-cyclopropylpiperazine-2-carbonitrile

Structural Information

Molecular Formula
C8H13N3
SMILES
C1CC1N2CCNCC2C#N
InChI
InChI=1S/C8H13N3/c9-5-8-6-10-3-4-11(8)7-1-2-7/h7-8,10H,1-4,6H2
InChIKey
HVIXJTLUHJSOIV-UHFFFAOYSA-N
Compound name
1-cyclopropylpiperazine-2-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

151.11095 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.118226 131.6
[M+Na]+ 174.100168 144.8
[M-H]- 150.103674 135.5
[M+NH4]+ 169.144773 144.8
[M+K]+ 190.074108 138.2
[M+H-H2O]+ 134.108210 120.2
[M+HCOO]- 196.109151 147.6
[M+CH3COO]- 210.124801 143.3
[M+Na-2H]- 172.085616 138.1
[M]+ 151.11040142 124.9
[M]- 151.11149858 124.9
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