CID 10798210

3-bromo-1-cyclopropylpyrrolidin-2-one

Structural Information

Molecular Formula

C₇H₁₀BrNO

SMILES

C1CC1N2CCC(C2=O)Br

InChI

InChI=1S/C7H10BrNO/c8-6-3-4-9(7(6)10)5-1-2-5/h5-6H,1-4H2

InChIKey

FLMMYHHUFMMQRD-UHFFFAOYSA-N

Compound name

3-bromo-1-cyclopropylpyrrolidin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 36
Patents: 202.99458 Da
Monoisotopic Mass: 1.2
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]+	204.00186	133.7
[M+Na]+	225.98380	137.1
[M+NH4]+	221.02840	139.4
[M+K]+	241.95774	140.0
[M-H]-	201.98730	140.1
[M+Na-2H]-	223.96925	138.4
[M]+	202.99403	135.7
[M]-	202.99513	135.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe