CID 121208179

2445794-78-3

Structural Information

Molecular Formula

C₇H₁₃F₂N

SMILES

CCNCC1CC(C1)(F)F

InChI

InChI=1S/C7H13F2N/c1-2-10-5-6-3-7(8,9)4-6/h6,10H,2-5H2,1H3

InChIKey

VWHNTLUFIIKEMH-UHFFFAOYSA-N

Compound name

N-[(3,3-difluorocyclobutyl)methyl]ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 149.10161 Da
Monoisotopic Mass: 1.6
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]+	150.10889	136.8
[M+Na]+	172.09083	141.2
[M+NH4]+	167.13543	141.7
[M+K]+	188.06477	135.2
[M-H]-	148.09433	133.5
[M+Na-2H]-	170.07628	139.4
[M]+	149.10106	135.2
[M]-	149.10216	135.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe