CID 5708720

29118-24-9

Structural Information

Molecular Formula

C₃H₂F₄

SMILES

C(=C/F)\C(F)(F)F

InChI

InChI=1S/C3H2F4/c4-2-1-3(5,6)7/h1-2H/b2-1+

InChIKey

CDOOAUSHHFGWSA-OWOJBTEDSA-N

Compound name

(E)-1,3,3,3-tetrafluoroprop-1-ene

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 7
References: 20979
Patents: 114.00926 Da
Monoisotopic Mass: 1.7
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]+	115.01654	113.0
[M+Na]+	136.99848	122.4
[M-H]-	113.00198	108.7
[M+NH4]+	132.04308	135.7
[M+K]+	152.97242	121.3
[M+H-H2O]+	97.006520	106.3
[M+HCOO]-	159.00746	132.2
[M+CH3COO]-	173.02311	167.6
[M+Na-2H]-	134.98393	120.1
[M]+	114.00871	106.7
[M]-	114.00981	106.7

Literature stripe

literature stripe

Patent stripe

patents stripe