CID 165979734

1-(2-bromoethyl)cyclopropane-1-carbonitrile

Structural Information

Molecular Formula
C6H8BrN
SMILES
C1CC1(CCBr)C#N
InChI
InChI=1S/C6H8BrN/c7-4-3-6(5-8)1-2-6/h1-4H2
InChIKey
BPHUELXGLIRUIV-UHFFFAOYSA-N
Compound name
1-(2-bromoethyl)cyclopropane-1-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

172.98401 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.99129 124.3
[M+Na]+ 195.97323 128.6
[M+NH4]+ 191.01783 128.8
[M+K]+ 211.94717 125.6
[M-H]- 171.97673 124.2
[M+Na-2H]- 193.95868 129.2
[M]+ 172.98346 124.2
[M]- 172.98456 124.2
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.