CID 124251827

1h-imidazole-2-sulfonyl fluoride

Structural Information

Molecular Formula

C₃H₃FN₂O₂S

SMILES

C1=CN=C(N1)S(=O)(=O)F

InChI

InChI=1S/C3H3FN2O2S/c4-9(7,8)3-5-1-2-6-3/h1-2H,(H,5,6)

InChIKey

MCCYVBQYXGJZGO-UHFFFAOYSA-N

Compound name

1H-imidazole-2-sulfonyl fluoride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 22
Patents: 149.98993 Da
Monoisotopic Mass: 0.2
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]+	150.99721	127.3
[M+Na]+	172.97915	136.6
[M+NH4]+	168.02375	133.6
[M+K]+	188.95309	132.9
[M-H]-	148.98265	124.2
[M+Na-2H]-	170.96460	130.8
[M]+	149.98938	127.8
[M]-	149.99048	127.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe