CID 3008674

1-ethoxy-6,6-dimethyl-1,3,5-triazine-2,4-diamine

Structural Information

Molecular Formula
C7H15N5O
SMILES
CCON1C(=NC(=NC1(C)C)N)N
InChI
InChI=1S/C7H15N5O/c1-4-13-12-6(9)10-5(8)11-7(12,2)3/h4H2,1-3H3,(H4,8,9,10,11)
InChIKey
DYFGWVBEYPUOIC-UHFFFAOYSA-N
Compound name
1-ethoxy-6,6-dimethyl-1,3,5-triazine-2,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

185.12766 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.13494 141.1
[M+Na]+ 208.11688 150.5
[M-H]- 184.12038 140.6
[M+NH4]+ 203.16148 158.6
[M+K]+ 224.09082 148.8
[M+H-H2O]+ 168.12492 134.0
[M+HCOO]- 230.12586 162.0
[M+CH3COO]- 244.14151 187.6
[M+Na-2H]- 206.10233 147.1
[M]+ 185.12711 139.9
[M]- 185.12821 139.9
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.