CID 202116

Sd 4201

Structural Information

Molecular Formula
C8H15N5O
SMILES
CN(C)CCOC1=NC(=NC(=C1)N)N
InChI
InChI=1S/C8H15N5O/c1-13(2)3-4-14-7-5-6(9)11-8(10)12-7/h5H,3-4H2,1-2H3,(H4,9,10,11,12)
InChIKey
AMOIXPZXUWPDNX-UHFFFAOYSA-N
Compound name
6-[2-(dimethylamino)ethoxy]pyrimidine-2,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.12766 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.13494 142.6
[M+Na]+ 220.11688 152.3
[M+NH4]+ 215.16148 149.0
[M+K]+ 236.09082 148.1
[M-H]- 196.12038 144.5
[M+Na-2H]- 218.10233 148.1
[M]+ 197.12711 144.1
[M]- 197.12821 144.1
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.