CID 3056613

Alpha-cyclohexyl-3-thiopheneacetamide

Structural Information

Molecular Formula
C12H17NOS
SMILES
C1CCC(CC1)C(C2=CSC=C2)C(=O)N
InChI
InChI=1S/C12H17NOS/c13-12(14)11(10-6-7-15-8-10)9-4-2-1-3-5-9/h6-9,11H,1-5H2,(H2,13,14)
InChIKey
NIRFQDLKYZQNBP-UHFFFAOYSA-N
Compound name
2-cyclohexyl-2-thiophen-3-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

223.10309 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.11037 150.6
[M+Na]+ 246.09231 158.8
[M+NH4]+ 241.13691 159.6
[M+K]+ 262.06625 153.1
[M-H]- 222.09581 154.3
[M+Na-2H]- 244.07776 155.5
[M]+ 223.10254 153.0
[M]- 223.10364 153.0
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.