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]+ 202.03778 142.9
[M+Na]+ 224.01972 153.4
[M-H]- 200.02322 148.3
[M+NH4]+ 219.06432 155.4
[M+K]+ 239.99366 150.0
[M+H-H2O]+ 184.02776 135.3
[M+HCOO]- 246.02870 161.4
[M+CH3COO]- 260.04435 185.6
[M+Na-2H]- 222.00517 148.2
[M]+ 201.02995 148.0
[M]- 201.03105 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.