CID 3057068

S-triazine, 2,4-bis(ethylamino)-6-isopropoxy-

Structural Information

Molecular Formula
C10H19N5O
SMILES
CCNC1=NC(=NC(=N1)OC(C)C)NCC
InChI
InChI=1S/C10H19N5O/c1-5-11-8-13-9(12-6-2)15-10(14-8)16-7(3)4/h7H,5-6H2,1-4H3,(H2,11,12,13,14,15)
InChIKey
VSGJJDIERZZRKV-UHFFFAOYSA-N
Compound name
2-N,4-N-diethyl-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

225.15897 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.166246 153.8
[M+Na]+ 248.148188 160.7
[M-H]- 224.151694 153.5
[M+NH4]+ 243.192793 167.8
[M+K]+ 264.122128 158.9
[M+H-H2O]+ 208.156230 144.8
[M+HCOO]- 270.157171 175.4
[M+CH3COO]- 284.172821 197.6
[M+Na-2H]- 246.133636 159.7
[M]+ 225.15842142 155.7
[M]- 225.15951858 155.7
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.