CID 279722

1-bromocyclobutane-1-carboxamide

Structural Information

Molecular Formula
C5H8BrNO
SMILES
C1CC(C1)(C(=O)N)Br
InChI
InChI=1S/C5H8BrNO/c6-5(4(7)8)2-1-3-5/h1-3H2,(H2,7,8)
InChIKey
NWTUHUOQBOFSPL-UHFFFAOYSA-N
Compound name
1-bromocyclobutane-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

176.97893 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.986206 124.1
[M+Na]+ 199.968148 133.2
[M-H]- 175.971654 129.9
[M+NH4]+ 195.012753 142.5
[M+K]+ 215.942088 126.4
[M+H-H2O]+ 159.976190 120.6
[M+HCOO]- 221.977131 143.9
[M+CH3COO]- 235.992781 181.9
[M+Na-2H]- 197.953596 131.7
[M]+ 176.97838142 147.0
[M]- 176.97947858 147.0
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.