CID 7589309

84946-01-0

Structural Information

Molecular Formula
C11H22N6
SMILES
CCNC1=NC(=NC(=N1)NC(C)C)NC(C)C
InChI
InChI=1S/C11H22N6/c1-6-12-9-15-10(13-7(2)3)17-11(16-9)14-8(4)5/h7-8H,6H2,1-5H3,(H3,12,13,14,15,16,17)
InChIKey
JXSQHULMJXTBLU-UHFFFAOYSA-N
Compound name
6-N-ethyl-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4,6-triamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.1906 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.197876 159.6
[M+Na]+ 261.179818 165.1
[M-H]- 237.183324 159.4
[M+NH4]+ 256.224423 172.7
[M+K]+ 277.153758 163.0
[M+H-H2O]+ 221.187860 150.4
[M+HCOO]- 283.188801 180.7
[M+CH3COO]- 297.204451 204.6
[M+Na-2H]- 259.165266 164.2
[M]+ 238.19005142 159.1
[M]- 238.19114858 159.1
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.