CID 7589453

35651-07-1

Structural Information

Molecular Formula
C11H22N6
SMILES
CCNC1=NC(=NC(=N1)NC(C)(C)C)NCC
InChI
InChI=1S/C11H22N6/c1-6-12-8-14-9(13-7-2)16-10(15-8)17-11(3,4)5/h6-7H2,1-5H3,(H3,12,13,14,15,16,17)
InChIKey
UBCBDPVUYWSIIT-UHFFFAOYSA-N
Compound name
2-N-tert-butyl-4-N,6-N-diethyl-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 160.3
[M+Na]+ 261.179818 166.8
[M-H]- 237.183324 160.2
[M+NH4]+ 256.224423 173.7
[M+K]+ 277.153758 164.1
[M+H-H2O]+ 221.187860 151.5
[M+HCOO]- 283.188801 181.7
[M+CH3COO]- 297.204451 202.5
[M+Na-2H]- 259.165266 167.9
[M]+ 238.19005142 160.4
[M]- 238.19114858 160.4
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.