CID 3073351

Ethanol, 2,2'-((4-(cyclopropylamino)-6-propyl-1,3,5-triazin-2-yl)imino)bis-, monohydrochloride

Structural Information

Molecular Formula
C13H23N5O2
SMILES
CCCC1=NC(=NC(=N1)N(CCO)CCO)NC2CC2
InChI
InChI=1S/C13H23N5O2/c1-2-3-11-15-12(14-10-4-5-10)17-13(16-11)18(6-8-19)7-9-20/h10,19-20H,2-9H2,1H3,(H,14,15,16,17)
InChIKey
FFJRCVWUKCVNBS-UHFFFAOYSA-N
Compound name
2-[[4-(cyclopropylamino)-6-propyl-1,3,5-triazin-2-yl]-(2-hydroxyethyl)amino]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

281.18518 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.19246 165.2
[M+Na]+ 304.17440 175.7
[M+NH4]+ 299.21900 170.8
[M+K]+ 320.14834 172.5
[M-H]- 280.17790 173.0
[M+Na-2H]- 302.15985 172.3
[M]+ 281.18463 169.6
[M]- 281.18573 169.6
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.