CID 11788380

Pent-4-ene-1-sulfonamide

Structural Information

Molecular Formula

C₅H₁₁NO₂S

SMILES

C=CCCCS(=O)(=O)N

InChI

InChI=1S/C5H11NO2S/c1-2-3-4-5-9(6,7)8/h2H,1,3-5H2,(H2,6,7,8)

InChIKey

GUYDOCPILYZNEK-UHFFFAOYSA-N

Compound name

pent-4-ene-1-sulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 167
Patents: 149.05106 Da
Monoisotopic Mass: 0.4
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]+	150.05834	129.3
[M+Na]+	172.04028	137.1
[M-H]-	148.04378	129.4
[M+NH4]+	167.08488	150.5
[M+K]+	188.01422	134.8
[M+H-H2O]+	132.04832	124.6
[M+HCOO]-	194.04926	147.6
[M+CH3COO]-	208.06491	173.7
[M+Na-2H]-	170.02573	133.1
[M]+	149.05051	130.5
[M]-	149.05161	130.5

Literature stripe

literature stripe

Patent stripe

patents stripe