CID 17750124

2-cyclopropyl-4-(dimethoxymethyl)pyrimidine

Structural Information

Molecular Formula
C10H14N2O2
SMILES
COC(C1=NC(=NC=C1)C2CC2)OC
InChI
InChI=1S/C10H14N2O2/c1-13-10(14-2)8-5-6-11-9(12-8)7-3-4-7/h5-7,10H,3-4H2,1-2H3
InChIKey
BAXOPTJKEYXLCH-UHFFFAOYSA-N
Compound name
2-cyclopropyl-4-(dimethoxymethyl)pyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

30
Patents

194.10553 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.112806 148.1
[M+Na]+ 217.094748 157.7
[M-H]- 193.098254 153.0
[M+NH4]+ 212.139353 160.2
[M+K]+ 233.068688 155.1
[M+H-H2O]+ 177.102790 139.7
[M+HCOO]- 239.103731 169.8
[M+CH3COO]- 253.119381 187.4
[M+Na-2H]- 215.080196 153.7
[M]+ 194.10498142 152.8
[M]- 194.10607858 152.8
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