CID 27777

Nsc298112

Structural Information

Molecular Formula
C11H22N6
SMILES
CCN(CC)C1=NC(=NC(=N1)N(C)C)N(C)C
InChI
InChI=1S/C11H22N6/c1-7-17(8-2)11-13-9(15(3)4)12-10(14-11)16(5)6/h7-8H2,1-6H3
InChIKey
LGLQBSMADBVAHQ-UHFFFAOYSA-N
Compound name
2-N,2-N-diethyl-4-N,4-N,6-N,6-N-tetramethyl-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

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.19788 158.8
[M+Na]+ 261.17982 165.3
[M-H]- 237.18332 162.8
[M+NH4]+ 256.22442 174.0
[M+K]+ 277.15376 166.3
[M+H-H2O]+ 221.18786 148.8
[M+HCOO]- 283.18880 183.4
[M+CH3COO]- 297.20445 213.0
[M+Na-2H]- 259.16527 163.8
[M]+ 238.19005 163.4
[M]- 238.19115 163.4
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.