CID 67895

2,2-difluoropropane

Structural Information

Molecular Formula

C₃H₆F₂

SMILES

CC(C)(F)F

InChI

InChI=1S/C3H6F2/c1-3(2,4)5/h1-2H3

InChIKey

YZXSQDNPKVBDOG-UHFFFAOYSA-N

Compound name

2,2-difluoropropane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 5831
Patents: 80.043755 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]+	81.051031	108.9
[M+Na]+	103.03297	117.9
[M-H]-	79.036479	107.4
[M+NH4]+	98.077578	133.3
[M+K]+	119.00691	118.3
[M+H-H2O]+	63.041015	104.2
[M+HCOO]-	125.04196	130.1
[M+CH3COO]-	139.05761	164.1
[M+Na-2H]-	101.01842	117.3
[M]+	80.043206	106.1
[M]-	80.044304	106.1

Literature stripe

literature stripe

Patent stripe

patents stripe