CID 90148344

1-(hydroxymethyl)cyclopropane-1-sulfonamide

Structural Information

Molecular Formula
C4H9NO3S
SMILES
C1CC1(CO)S(=O)(=O)N
InChI
InChI=1S/C4H9NO3S/c5-9(7,8)4(3-6)1-2-4/h6H,1-3H2,(H2,5,7,8)
InChIKey
CQRDTMLTMKCWAM-UHFFFAOYSA-N
Compound name
1-(hydroxymethyl)cyclopropane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

151.03032 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.037596 125.4
[M+Na]+ 174.019538 135.0
[M-H]- 150.023044 128.6
[M+NH4]+ 169.064143 142.7
[M+K]+ 189.993478 132.6
[M+H-H2O]+ 134.027580 121.6
[M+HCOO]- 196.028521 142.7
[M+CH3COO]- 210.044171 172.9
[M+Na-2H]- 172.004986 131.8
[M]+ 151.02977142 128.5
[M]- 151.03086858 128.5
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