CID 61746431

1306965-59-2

Structural Information

Molecular Formula
C14H29N3
SMILES
CNC1CCCCC1N(C)C2CCN(CC2)C
InChI
InChI=1S/C14H29N3/c1-15-13-6-4-5-7-14(13)17(3)12-8-10-16(2)11-9-12/h12-15H,4-11H2,1-3H3
InChIKey
SQXROZHTTFVFOL-UHFFFAOYSA-N
Compound name
1-N,2-N-dimethyl-2-N-(1-methylpiperidin-4-yl)cyclohexane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

239.23615 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.24343 161.1
[M+Na]+ 262.22537 161.7
[M-H]- 238.22887 165.6
[M+NH4]+ 257.26997 176.9
[M+K]+ 278.19931 160.3
[M+H-H2O]+ 222.23341 152.2
[M+HCOO]- 284.23435 177.9
[M+CH3COO]- 298.25000 202.4
[M+Na-2H]- 260.21082 161.6
[M]+ 239.23560 152.6
[M]- 239.23670 152.6
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.