CID 165948402

2694744-82-4

Structural Information

Molecular Formula
C9H10N2O3
SMILES
COC1=NC=C(N=C1)C2(CC2)C(=O)O
InChI
InChI=1S/C9H10N2O3/c1-14-7-5-10-6(4-11-7)9(2-3-9)8(12)13/h4-5H,2-3H2,1H3,(H,12,13)
InChIKey
QKKWGBREUMPXRZ-UHFFFAOYSA-N
Compound name
1-(5-methoxypyrazin-2-yl)cyclopropane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.06914 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.07642 146.5
[M+Na]+ 217.05836 156.9
[M-H]- 193.06186 150.6
[M+NH4]+ 212.10296 159.6
[M+K]+ 233.03230 154.5
[M+H-H2O]+ 177.06640 139.6
[M+HCOO]- 239.06734 167.0
[M+CH3COO]- 253.08299 182.8
[M+Na-2H]- 215.04381 153.2
[M]+ 194.06859 150.3
[M]- 194.06969 150.3
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.