CID 216923

37853-38-6

Structural Information

Molecular Formula
C10H9ClN2O3
SMILES
CC(C(=O)NC1=CC(=NO1)C2=CC=CO2)Cl
InChI
InChI=1S/C10H9ClN2O3/c1-6(11)10(14)12-9-5-7(13-16-9)8-3-2-4-15-8/h2-6H,1H3,(H,12,14)
InChIKey
NMVHEDPJAONNPH-UHFFFAOYSA-N
Compound name
2-chloro-N-[3-(furan-2-yl)-1,2-oxazol-5-yl]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.03017 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.037446 151.4
[M+Na]+ 263.019388 160.8
[M-H]- 239.022894 159.0
[M+NH4]+ 258.063993 168.8
[M+K]+ 278.993328 159.9
[M+H-H2O]+ 223.027430 145.3
[M+HCOO]- 285.028371 171.9
[M+CH3COO]- 299.044021 189.0
[M+Na-2H]- 261.004836 155.5
[M]+ 240.02962142 157.6
[M]- 240.03071858 157.6
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.