CID 6438265

Alpha-(beta-(2-thienyl)styryl)-1-piperidineethanol maleate

Structural Information

Molecular Formula
C19H23NOS
SMILES
C1CCN(CC1)CC(/C=C(\C2=CC=CC=C2)/C3=CC=CS3)O
InChI
InChI=1S/C19H23NOS/c21-17(15-20-11-5-2-6-12-20)14-18(19-10-7-13-22-19)16-8-3-1-4-9-16/h1,3-4,7-10,13-14,17,21H,2,5-6,11-12,15H2/b18-14+
InChIKey
VTSFJHOLRGPNAJ-NBVRZTHBSA-N
Compound name
(E)-4-phenyl-1-piperidin-1-yl-4-thiophen-2-ylbut-3-en-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

313.15002 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 314.15730 174.3
[M+Na]+ 336.13924 185.0
[M+NH4]+ 331.18384 183.0
[M+K]+ 352.11318 177.2
[M-H]- 312.14274 179.3
[M+Na-2H]- 334.12469 181.5
[M]+ 313.14947 177.6
[M]- 313.15057 177.6
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.