CID 20462682

N-allylethenesulfonamide

Structural Information

Molecular Formula
C5H9NO2S
SMILES
C=CCNS(=O)(=O)C=C
InChI
InChI=1S/C5H9NO2S/c1-3-5-6-9(7,8)4-2/h3-4,6H,1-2,5H2
InChIKey
CHICVXSQEMYXAN-UHFFFAOYSA-N
Compound name
N-prop-2-enylethenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

100
Patents

147.0354 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.04268 127.7
[M+Na]+ 170.02462 135.8
[M-H]- 146.02812 128.4
[M+NH4]+ 165.06922 149.2
[M+K]+ 185.99856 133.3
[M+H-H2O]+ 130.03266 123.1
[M+HCOO]- 192.03360 146.9
[M+CH3COO]- 206.04925 173.4
[M+Na-2H]- 168.01007 132.6
[M]+ 147.03485 129.3
[M]- 147.03595 129.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe