CID 239511

N-hydroxythiophene-2-carboxamide

Structural Information

Molecular Formula
C5H5NO2S
SMILES
C1=CSC(=C1)C(=O)NO
InChI
InChI=1S/C5H5NO2S/c7-5(6-8)4-2-1-3-9-4/h1-3,8H,(H,6,7)
InChIKey
XNSXTZGRPNUMTQ-UHFFFAOYSA-N
Compound name
N-hydroxythiophene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

92
Patents

143.0041 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.01138 126.4
[M+Na]+ 165.99332 134.4
[M-H]- 141.99682 129.3
[M+NH4]+ 161.03792 149.1
[M+K]+ 181.96726 132.6
[M+H-H2O]+ 126.00136 121.3
[M+HCOO]- 188.00230 146.7
[M+CH3COO]- 202.01795 168.7
[M+Na-2H]- 163.97877 129.7
[M]+ 143.00355 126.6
[M]- 143.00465 126.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe