CID 5325774

6-chloro-3-methyl-[1,2]oxazolo[4,5-c]pyridine

Structural Information

Molecular Formula
C7H5ClN2O
SMILES
CC1=NOC2=CC(=NC=C12)Cl
InChI
InChI=1S/C7H5ClN2O/c1-4-5-3-9-7(8)2-6(5)11-10-4/h2-3H,1H3
InChIKey
GCSRGLDJYXQOSI-UHFFFAOYSA-N
Compound name
6-chloro-3-methyl-[1,2]oxazolo[4,5-c]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

168.00903 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.01631 128.0
[M+Na]+ 190.99825 141.5
[M-H]- 167.00175 131.5
[M+NH4]+ 186.04285 148.9
[M+K]+ 206.97219 138.6
[M+H-H2O]+ 151.00629 122.1
[M+HCOO]- 213.00723 147.2
[M+CH3COO]- 227.02288 143.5
[M+Na-2H]- 188.98370 137.5
[M]+ 168.00848 133.8
[M]- 168.00958 133.8
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.