CID 210739

Morpholine, 4-(1-(2-thienyl)cyclohexyl)-, hydrochloride

Structural Information

Molecular Formula

C₁₄H₂₁NOS

SMILES

C1CCC(CC1)(C2=CC=CS2)N3CCOCC3

InChI

InChI=1S/C14H21NOS/c1-2-6-14(7-3-1,13-5-4-12-17-13)15-8-10-16-11-9-15/h4-5,12H,1-3,6-11H2

InChIKey

QBLUKXGKYQEPBB-UHFFFAOYSA-N

Compound name

4-(1-thiophen-2-ylcyclohexyl)morpholine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 1
Patents: 251.13438 Da
Monoisotopic Mass: 2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	252.14166	157.6
[M+Na]+	274.12360	168.4
[M+NH4]+	269.16820	169.1
[M+K]+	290.09754	159.1
[M-H]-	250.12710	164.6
[M+Na-2H]-	272.10905	165.7
[M]+	251.13383	161.7
[M]-	251.13493	161.7

Literature stripe

literature stripe

Patent stripe

patents stripe