CID 91691095

4-(dimethoxymethyl)-2-(propan-2-yl)pyrimidine

Structural Information

Molecular Formula
C10H16N2O2
SMILES
CC(C)C1=NC=CC(=N1)C(OC)OC
InChI
InChI=1S/C10H16N2O2/c1-7(2)9-11-6-5-8(12-9)10(13-3)14-4/h5-7,10H,1-4H3
InChIKey
FYOCNHQRCHITOA-UHFFFAOYSA-N
Compound name
4-(dimethoxymethyl)-2-propan-2-ylpyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

196.12119 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.128466 143.7
[M+Na]+ 219.110408 151.1
[M-H]- 195.113914 144.6
[M+NH4]+ 214.155013 160.5
[M+K]+ 235.084348 150.6
[M+H-H2O]+ 179.118450 136.1
[M+HCOO]- 241.119391 163.8
[M+CH3COO]- 255.135041 186.6
[M+Na-2H]- 217.095856 148.3
[M]+ 196.12064142 147.0
[M]- 196.12173858 147.0
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