CID 2113341

24372-48-3

Structural Information

Molecular Formula
C10H13NOS
SMILES
C1CCN(CC1)C2=CC=C(S2)C=O
InChI
InChI=1S/C10H13NOS/c12-8-9-4-5-10(13-9)11-6-2-1-3-7-11/h4-5,8H,1-3,6-7H2
InChIKey
SFDXRMCPPLZJBG-UHFFFAOYSA-N
Compound name
5-piperidin-1-ylthiophene-2-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

40
Patents

195.0718 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.07908 142.7
[M+Na]+ 218.06102 153.8
[M+NH4]+ 213.10562 152.2
[M+K]+ 234.03496 146.7
[M-H]- 194.06452 146.1
[M+Na-2H]- 216.04647 148.6
[M]+ 195.07125 145.6
[M]- 195.07235 145.6
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