CID 23394529

4,4-difluoro-1-methylpiperidine

Structural Information

Molecular Formula

C₆H₁₁F₂N

SMILES

CN1CCC(CC1)(F)F

InChI

InChI=1S/C6H11F2N/c1-9-4-2-6(7,8)3-5-9/h2-5H2,1H3

InChIKey

LFHMKODCPPOLIB-UHFFFAOYSA-N

Compound name

4,4-difluoro-1-methylpiperidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 876
Patents: 135.08595 Da
Monoisotopic Mass: 1.4
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]+	136.09323	129.9
[M+Na]+	158.07517	139.8
[M+NH4]+	153.11977	139.0
[M+K]+	174.04911	131.9
[M-H]-	134.07867	128.8
[M+Na-2H]-	156.06062	135.6
[M]+	135.08540	130.9
[M]-	135.08650	130.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe