CID 28739405

N-(4-hydroxyphenyl)thiophene-3-carboxamide

Structural Information

Molecular Formula
C11H9NO2S
SMILES
C1=CC(=CC=C1NC(=O)C2=CSC=C2)O
InChI
InChI=1S/C11H9NO2S/c13-10-3-1-9(2-4-10)12-11(14)8-5-6-15-7-8/h1-7,13H,(H,12,14)
InChIKey
IKAKSUABEFMICS-UHFFFAOYSA-N
Compound name
N-(4-hydroxyphenyl)thiophene-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

219.0354 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.04268 146.0
[M+Na]+ 242.02462 153.9
[M-H]- 218.02812 152.1
[M+NH4]+ 237.06922 165.7
[M+K]+ 257.99856 150.0
[M+H-H2O]+ 202.03266 139.9
[M+HCOO]- 264.03360 166.2
[M+CH3COO]- 278.04925 183.5
[M+Na-2H]- 240.01007 148.4
[M]+ 219.03485 146.5
[M]- 219.03595 146.5
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