CID 15626101

4-ethenyl-2,6-dimethylpyrimidine

Structural Information

Molecular Formula
C8H10N2
SMILES
CC1=CC(=NC(=N1)C)C=C
InChI
InChI=1S/C8H10N2/c1-4-8-5-6(2)9-7(3)10-8/h4-5H,1H2,2-3H3
InChIKey
WTOVTOPNAJJTAD-UHFFFAOYSA-N
Compound name
4-ethenyl-2,6-dimethylpyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

134.0844 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 135.09168 126.1
[M+Na]+ 157.07362 136.3
[M-H]- 133.07712 127.6
[M+NH4]+ 152.11822 146.0
[M+K]+ 173.04756 133.9
[M+H-H2O]+ 117.08166 119.5
[M+HCOO]- 179.08260 148.6
[M+CH3COO]- 193.09825 175.1
[M+Na-2H]- 155.05907 133.7
[M]+ 134.08385 126.8
[M]- 134.08495 126.8
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