CID 71434407

100868-74-4

Structural Information

Molecular Formula
C7H10N2O2
SMILES
CC1=C(N=C(C(=O)N1)OC)C
InChI
InChI=1S/C7H10N2O2/c1-4-5(2)9-7(11-3)6(10)8-4/h1-3H3,(H,8,10)
InChIKey
WVYMPXKTAQJEGL-UHFFFAOYSA-N
Compound name
3-methoxy-5,6-dimethyl-1H-pyrazin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

154.07423 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.081506 129.1
[M+Na]+ 177.063448 140.1
[M-H]- 153.066954 129.8
[M+NH4]+ 172.108053 147.7
[M+K]+ 193.037388 137.9
[M+H-H2O]+ 137.071490 122.8
[M+HCOO]- 199.072431 150.8
[M+CH3COO]- 213.088081 174.7
[M+Na-2H]- 175.048896 135.8
[M]+ 154.07368142 130.8
[M]- 154.07477858 130.8
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

No patent data available for this compound.