CID 2736218

387350-76-7

Structural Information

Molecular Formula
C11H18N4O2
SMILES
COC1=CC(=NC(=N1)CN2CCNCC2)OC
InChI
InChI=1S/C11H18N4O2/c1-16-10-7-11(17-2)14-9(13-10)8-15-5-3-12-4-6-15/h7,12H,3-6,8H2,1-2H3
InChIKey
RZNQZUBONDNTBD-UHFFFAOYSA-N
Compound name
4,6-dimethoxy-2-(piperazin-1-ylmethyl)pyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

238.14297 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.15025 157.1
[M+Na]+ 261.13219 163.3
[M-H]- 237.13569 156.2
[M+NH4]+ 256.17679 168.3
[M+K]+ 277.10613 160.0
[M+H-H2O]+ 221.14023 146.8
[M+HCOO]- 283.14117 171.6
[M+CH3COO]- 297.15682 189.0
[M+Na-2H]- 259.11764 161.7
[M]+ 238.14242 154.6
[M]- 238.14352 154.6
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

patents stripe