CID 385273

Nsc676384

Structural Information

Molecular Formula
C11H20N4O
SMILES
CC1C=C(NC(=N1)N)NCC2(CCC2)CO
InChI
InChI=1S/C11H20N4O/c1-8-5-9(15-10(12)14-8)13-6-11(7-16)3-2-4-11/h5,8,13,16H,2-4,6-7H2,1H3,(H3,12,14,15)
InChIKey
IHTYPNQYXHAKJA-UHFFFAOYSA-N
Compound name
[1-[[(2-amino-4-methyl-1,4-dihydropyrimidin-6-yl)amino]methyl]cyclobutyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.16371 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.17099 157.1
[M+Na]+ 247.15293 160.8
[M-H]- 223.15643 157.4
[M+NH4]+ 242.19753 165.8
[M+K]+ 263.12687 160.2
[M+H-H2O]+ 207.16097 143.9
[M+HCOO]- 269.16191 173.5
[M+CH3COO]- 283.17756 192.7
[M+Na-2H]- 245.13838 160.6
[M]+ 224.16316 159.3
[M]- 224.16426 159.3
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.