CID 250985

Heptafluorobutyrylamidine

Structural Information

Molecular Formula

C₄H₃F₇N₂

SMILES

C(=N)(C(C(C(F)(F)F)(F)F)(F)F)N

InChI

InChI=1S/C4H3F7N2/c5-2(6,1(12)13)3(7,8)4(9,10)11/h(H3,12,13)

InChIKey

HYMJOTOLJAHZCH-UHFFFAOYSA-N

Compound name

2,2,3,3,4,4,4-heptafluorobutanimidamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 88
Patents: 212.01845 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]+	213.02573	161.9
[M+Na]+	235.00767	163.2
[M+NH4]+	230.05227	162.5
[M+K]+	250.98161	161.2
[M-H]-	211.01117	153.4
[M+Na-2H]-	232.99312	159.9
[M]+	212.01790	159.1
[M]-	212.01900	159.1

Literature stripe

literature stripe

Patent stripe

patents stripe