CID 155820562

2460749-88-4

Structural Information

Molecular Formula
C11H18N4O2
SMILES
CC1=NC(=NC=C1N)CNC(=O)OC(C)(C)C
InChI
InChI=1S/C11H18N4O2/c1-7-8(12)5-13-9(15-7)6-14-10(16)17-11(2,3)4/h5H,6,12H2,1-4H3,(H,14,16)
InChIKey
LPPPHWGSTRPHPH-UHFFFAOYSA-N
Compound name
tert-butyl N-[(5-amino-4-methylpyrimidin-2-yl)methyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.14297 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.15025 155.3
[M+Na]+ 261.13219 164.7
[M+NH4]+ 256.17679 160.5
[M+K]+ 277.10613 161.2
[M-H]- 237.13569 155.2
[M+Na-2H]- 259.11764 159.5
[M]+ 238.14242 156.2
[M]- 238.14352 156.2
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.