CID 61699787

2-[(3-chloropyrazin-2-yl)oxy]ethan-1-ol

Structural Information

Molecular Formula
C6H7ClN2O2
SMILES
C1=CN=C(C(=N1)OCCO)Cl
InChI
InChI=1S/C6H7ClN2O2/c7-5-6(11-4-3-10)9-2-1-8-5/h1-2,10H,3-4H2
InChIKey
DEYORWXXQSDREV-UHFFFAOYSA-N
Compound name
2-(3-chloropyrazin-2-yl)oxyethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

174.0196 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.026876 130.4
[M+Na]+ 197.008818 140.2
[M-H]- 173.012324 130.1
[M+NH4]+ 192.053423 148.3
[M+K]+ 212.982758 137.1
[M+H-H2O]+ 157.016860 124.1
[M+HCOO]- 219.017801 147.6
[M+CH3COO]- 233.033451 174.0
[M+Na-2H]- 194.994266 138.7
[M]+ 174.01905142 133.3
[M]- 174.02014858 133.3
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.