CID 9589492

Piperidinomethylenedicyanodiamide

Structural Information

Molecular Formula
C8H13N5
SMILES
C1CCN(CC1)C=N/C=N/NC#N
InChI
InChI=1S/C8H13N5/c9-6-11-12-7-10-8-13-4-2-1-3-5-13/h7-8,11H,1-5H2/b10-8?,12-7+
InChIKey
ZHCAJGLYOWRGTH-VWZRABRQSA-N
Compound name
N'-(cyanoamino)-N-(piperidin-1-ylmethylidene)methanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

179.1171 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.12438 136.9
[M+Na]+ 202.10632 142.4
[M-H]- 178.10982 139.8
[M+NH4]+ 197.15092 153.3
[M+K]+ 218.08026 141.2
[M+H-H2O]+ 162.11436 122.1
[M+HCOO]- 224.11530 158.3
[M+CH3COO]- 238.13095 201.6
[M+Na-2H]- 200.09177 144.0
[M]+ 179.11655 127.8
[M]- 179.11765 127.8
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.