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

0
Patents

151.11095 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.11823 131.6
[M+Na]+ 174.10017 144.8
[M-H]- 150.10367 135.5
[M+NH4]+ 169.14477 144.8
[M+K]+ 190.07411 138.2
[M+H-H2O]+ 134.10821 120.2
[M+HCOO]- 196.10915 147.6
[M+CH3COO]- 210.12480 143.3
[M+Na-2H]- 172.08562 138.1
[M]+ 151.11040 124.9
[M]- 151.11150 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

No patent data available for this compound.