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]+ 196.079076 144.4
[M+Na]+ 218.061018 151.3
[M-H]- 194.064524 150.9
[M+NH4]+ 213.105623 168.9
[M+K]+ 234.034958 148.8
[M+H-H2O]+ 178.069060 139.5
[M+HCOO]- 240.070001 163.5
[M+CH3COO]- 254.085651 180.5
[M+Na-2H]- 216.046466 144.3
[M]+ 195.07125142 142.3
[M]- 195.07234858 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.