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

6
Patents

151.03032 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.03760 125.4
[M+Na]+ 174.01954 135.0
[M-H]- 150.02304 128.6
[M+NH4]+ 169.06414 142.7
[M+K]+ 189.99348 132.6
[M+H-H2O]+ 134.02758 121.6
[M+HCOO]- 196.02852 142.7
[M+CH3COO]- 210.04417 172.9
[M+Na-2H]- 172.00499 131.8
[M]+ 151.02977 128.5
[M]- 151.03087 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