CID 385271

Nsc676382

Structural Information

Molecular Formula
C11H20N4O2
SMILES
COC1C=C(NC(=N1)N)NCC2(CCC2)CO
InChI
InChI=1S/C11H20N4O2/c1-17-9-5-8(14-10(12)15-9)13-6-11(7-16)3-2-4-11/h5,9,13,16H,2-4,6-7H2,1H3,(H3,12,14,15)
InChIKey
GUQBMCCAWGEYSX-UHFFFAOYSA-N
Compound name
[1-[[(2-amino-4-methoxy-1,4-dihydropyrimidin-6-yl)amino]methyl]cyclobutyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.15863 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.16591 159.0
[M+Na]+ 263.14785 162.4
[M-H]- 239.15135 159.2
[M+NH4]+ 258.19245 167.0
[M+K]+ 279.12179 162.5
[M+H-H2O]+ 223.15589 145.5
[M+HCOO]- 285.15683 175.5
[M+CH3COO]- 299.17248 194.8
[M+Na-2H]- 261.13330 162.7
[M]+ 240.15808 162.6
[M]- 240.15918 162.6
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.