CID 2778141

Tert-butyl 2-fluoroacrylate

Structural Information

Molecular Formula

C₇H₁₁FO₂

SMILES

CC(C)(C)OC(=O)C(=C)F

InChI

InChI=1S/C7H11FO2/c1-5(8)6(9)10-7(2,3)4/h1H2,2-4H3

InChIKey

PRFZRHRJCVTLFD-UHFFFAOYSA-N

Compound name

tert-butyl 2-fluoroprop-2-enoate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 180
Patents: 146.07431 Da
Monoisotopic Mass: 2.5
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]+	147.08159	132.2
[M+Na]+	169.06353	140.8
[M+NH4]+	164.10813	138.4
[M+K]+	185.03747	137.3
[M-H]-	145.06703	128.6
[M+Na-2H]-	167.04898	134.2
[M]+	146.07376	132.1
[M]-	146.07486	132.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe