CID 54595617

2-chloro-n-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)acetamide

Structural Information

Molecular Formula
C7H8ClN3O2
SMILES
C1CC1C2=NOC(=N2)NC(=O)CCl
InChI
InChI=1S/C7H8ClN3O2/c8-3-5(12)9-7-10-6(11-13-7)4-1-2-4/h4H,1-3H2,(H,9,10,11,12)
InChIKey
RLBHFYVFVXOPST-UHFFFAOYSA-N
Compound name
2-chloro-N-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

201.0305 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.037776 142.9
[M+Na]+ 224.019718 153.4
[M-H]- 200.023224 148.3
[M+NH4]+ 219.064323 155.4
[M+K]+ 239.993658 150.0
[M+H-H2O]+ 184.027760 135.3
[M+HCOO]- 246.028701 161.4
[M+CH3COO]- 260.044351 185.6
[M+Na-2H]- 222.005166 148.2
[M]+ 201.02995142 148.0
[M]- 201.03104858 148.0
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.