CID 138040372

2243506-92-3

Structural Information

Molecular Formula
C5H8BrN
SMILES
C1CC(C(=C1)Br)N
InChI
InChI=1S/C5H8BrN/c6-4-2-1-3-5(4)7/h2,5H,1,3,7H2
InChIKey
MHBGPNCLLQCPEI-UHFFFAOYSA-N
Compound name
2-bromocyclopent-2-en-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

160.98401 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.99129 128.3
[M+Na]+ 183.97323 139.7
[M-H]- 159.97673 134.3
[M+NH4]+ 179.01783 153.8
[M+K]+ 199.94717 129.3
[M+H-H2O]+ 143.98127 128.7
[M+HCOO]- 205.98221 151.1
[M+CH3COO]- 219.99786 176.0
[M+Na-2H]- 181.95868 134.7
[M]+ 160.98346 143.1
[M]- 160.98456 143.1
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.