CID 855035

N-cyclohexylthiophene-2-carboxamide

Structural Information

Molecular Formula
C11H15NOS
SMILES
C1CCC(CC1)NC(=O)C2=CC=CS2
InChI
InChI=1S/C11H15NOS/c13-11(10-7-4-8-14-10)12-9-5-2-1-3-6-9/h4,7-9H,1-3,5-6H2,(H,12,13)
InChIKey
HFWTZGQRJHFPRF-UHFFFAOYSA-N
Compound name
N-cyclohexylthiophene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

144
Patents

209.08743 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.094706 147.0
[M+Na]+ 232.076648 151.5
[M-H]- 208.080154 153.0
[M+NH4]+ 227.121253 167.3
[M+K]+ 248.050588 148.7
[M+H-H2O]+ 192.084690 140.6
[M+HCOO]- 254.085631 164.2
[M+CH3COO]- 268.101281 183.9
[M+Na-2H]- 230.062096 147.4
[M]+ 209.08688142 143.3
[M]- 209.08797858 143.3
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