CID 21350881

198758-97-3

Structural Information

Molecular Formula
C4H6BrNO
SMILES
C1CC1(C(=O)N)Br
InChI
InChI=1S/C4H6BrNO/c5-4(1-2-4)3(6)7/h1-2H2,(H2,6,7)
InChIKey
RZWDXSFZQLTCTN-UHFFFAOYSA-N
Compound name
1-bromocyclopropane-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

162.96329 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.970566 125.1
[M+Na]+ 185.952508 138.2
[M-H]- 161.956014 132.3
[M+NH4]+ 180.997113 145.8
[M+K]+ 201.926448 128.0
[M+H-H2O]+ 145.960550 126.0
[M+HCOO]- 207.961491 146.9
[M+CH3COO]- 221.977141 179.6
[M+Na-2H]- 183.937956 133.7
[M]+ 162.96274142 143.3
[M]- 162.96383858 143.3
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

patents stripe