CID 9397977

1-(piperazin-1-yl)cyclopentane-1-carbonitrile

Structural Information

Molecular Formula
C10H17N3
SMILES
C1CCC(C1)(C#N)N2CCNCC2
InChI
InChI=1S/C10H17N3/c11-9-10(3-1-2-4-10)13-7-5-12-6-8-13/h12H,1-8H2
InChIKey
OMZRBDHPZQUXQS-UHFFFAOYSA-N
Compound name
1-piperazin-1-ylcyclopentane-1-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

179.14224 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.14952 139.5
[M+Na]+ 202.13146 146.0
[M-H]- 178.13496 140.0
[M+NH4]+ 197.17606 157.0
[M+K]+ 218.10540 141.0
[M+H-H2O]+ 162.13950 125.1
[M+HCOO]- 224.14044 151.8
[M+CH3COO]- 238.15609 148.8
[M+Na-2H]- 200.11691 142.7
[M]+ 179.14169 126.1
[M]- 179.14279 126.1
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.