CID 207511

Af 46

Structural Information

Molecular Formula
C14H25N7
SMILES
CN1CCN(CC1)CC2=NC(=NC(=N2)N3CCCCC3)N
InChI
InChI=1S/C14H25N7/c1-19-7-9-20(10-8-19)11-12-16-13(15)18-14(17-12)21-5-3-2-4-6-21/h2-11H2,1H3,(H2,15,16,17,18)
InChIKey
WVOFKCSIJHHMBM-UHFFFAOYSA-N
Compound name
4-[(4-methylpiperazin-1-yl)methyl]-6-piperidin-1-yl-1,3,5-triazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

291.21713 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.22441 177.7
[M+Na]+ 314.20635 181.7
[M-H]- 290.20985 177.2
[M+NH4]+ 309.25095 183.6
[M+K]+ 330.18029 175.9
[M+H-H2O]+ 274.21439 164.2
[M+HCOO]- 336.21533 186.7
[M+CH3COO]- 350.23098 183.8
[M+Na-2H]- 312.19180 179.1
[M]+ 291.21658 168.2
[M]- 291.21768 168.2
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.