CID 3069537

Brn 4447134

Structural Information

Molecular Formula
C14H26N4
SMILES
CN1CCCCC1=NCCN=C2CCCCN2C
InChI
InChI=1S/C14H26N4/c1-17-11-5-3-7-13(17)15-9-10-16-14-8-4-6-12-18(14)2/h3-12H2,1-2H3
InChIKey
XGKUPNKNFIUUPZ-UHFFFAOYSA-N
Compound name
1-methyl-N-[2-[(1-methylpiperidin-2-ylidene)amino]ethyl]piperidin-2-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

250.21574 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.22302 163.3
[M+Na]+ 273.20496 165.4
[M-H]- 249.20846 167.8
[M+NH4]+ 268.24956 178.1
[M+K]+ 289.17890 163.0
[M+H-H2O]+ 233.21300 153.0
[M+HCOO]- 295.21394 181.8
[M+CH3COO]- 309.22959 203.8
[M+Na-2H]- 271.19041 165.6
[M]+ 250.21519 156.3
[M]- 250.21629 156.3
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.