CID 3056604

Cyclopentanecarboxamide, 1-(3-thienyl)-

Structural Information

Molecular Formula
C10H13NOS
SMILES
C1CCC(C1)(C2=CSC=C2)C(=O)N
InChI
InChI=1S/C10H13NOS/c11-9(12)10(4-1-2-5-10)8-3-6-13-7-8/h3,6-7H,1-2,4-5H2,(H2,11,12)
InChIKey
PHSZIOZPUZOANV-UHFFFAOYSA-N
Compound name
1-thiophen-3-ylcyclopentane-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

195.0718 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.07908 144.4
[M+Na]+ 218.06102 151.3
[M-H]- 194.06452 150.9
[M+NH4]+ 213.10562 168.9
[M+K]+ 234.03496 148.8
[M+H-H2O]+ 178.06906 139.5
[M+HCOO]- 240.07000 163.5
[M+CH3COO]- 254.08565 180.5
[M+Na-2H]- 216.04647 144.3
[M]+ 195.07125 142.3
[M]- 195.07235 142.3
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

No patent data available for this compound.