CID 115531690

4-(dimethoxymethyl)-2-ethylpyrimidine

Structural Information

Molecular Formula
C9H14N2O2
SMILES
CCC1=NC=CC(=N1)C(OC)OC
InChI
InChI=1S/C9H14N2O2/c1-4-8-10-6-5-7(11-8)9(12-2)13-3/h5-6,9H,4H2,1-3H3
InChIKey
GENXSCLANIGYIA-UHFFFAOYSA-N
Compound name
4-(dimethoxymethyl)-2-ethylpyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

31
Patents

182.10553 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.112806 139.1
[M+Na]+ 205.094748 147.2
[M-H]- 181.098254 140.1
[M+NH4]+ 200.139353 156.6
[M+K]+ 221.068688 146.5
[M+H-H2O]+ 165.102790 131.6
[M+HCOO]- 227.103731 160.5
[M+CH3COO]- 241.119381 182.7
[M+Na-2H]- 203.080196 145.5
[M]+ 182.10498142 142.7
[M]- 182.10607858 142.7
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