CID 210895

21868-44-0

Structural Information

Molecular Formula
C13H22N6O
SMILES
C1CCN(CC1)CC2=NC(=NC(=N2)N3CCOCC3)N
InChI
InChI=1S/C13H22N6O/c14-12-15-11(10-18-4-2-1-3-5-18)16-13(17-12)19-6-8-20-9-7-19/h1-10H2,(H2,14,15,16,17)
InChIKey
VWAKJKCNEQAWPI-UHFFFAOYSA-N
Compound name
4-morpholin-4-yl-6-(piperidin-1-ylmethyl)-1,3,5-triazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

278.18552 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.19280 170.7
[M+Na]+ 301.17474 174.1
[M-H]- 277.17824 171.9
[M+NH4]+ 296.21934 176.8
[M+K]+ 317.14868 170.4
[M+H-H2O]+ 261.18278 157.6
[M+HCOO]- 323.18372 180.8
[M+CH3COO]- 337.19937 177.6
[M+Na-2H]- 299.16019 173.7
[M]+ 278.18497 161.8
[M]- 278.18607 161.8
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.