CID 78037

Bromocyclopropane

Structural Information

Molecular Formula

SMILES

C1CC1Br

InChI

InChI=1S/C3H5Br/c4-3-1-2-3/h3H,1-2H2

InChIKey

LKXYJYDRLBPHRS-UHFFFAOYSA-N

Compound name

bromocyclopropane

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 5
References: 6510
Patents: 119.95746 Da
Monoisotopic Mass: 1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	120.96474	116.3
[M+Na]+	142.94668	130.2
[M-H]-	118.95018	124.0
[M+NH4]+	137.99128	137.6
[M+K]+	158.92062	120.5
[M+H-H2O]+	102.95472	116.7
[M+HCOO]-	164.95566	139.0
[M+CH3COO]-	178.97131	172.2
[M+Na-2H]-	140.93213	126.5
[M]+	119.95691	135.1
[M]-	119.95801	135.1

Literature stripe

literature stripe

Patent stripe

patents stripe