CID 341039

2845-45-6

Structural Information

Molecular Formula

C₁₄H₁₇NO₂

SMILES

C=C(CN1CCOCC1)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C14H17NO2/c1-12(11-15-7-9-17-10-8-15)14(16)13-5-3-2-4-6-13/h2-6H,1,7-11H2

InChIKey

RQGMGBHZMJFENP-UHFFFAOYSA-N

Compound name

2-(morpholin-4-ylmethyl)-1-phenylprop-2-en-1-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 6
Patents: 231.12593 Da
Monoisotopic Mass: 1.7
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]+	232.133206	153.6
[M+Na]+	254.115148	157.1
[M-H]-	230.118654	158.1
[M+NH4]+	249.159753	167.8
[M+K]+	270.089088	155.5
[M+H-H2O]+	214.123190	145.2
[M+HCOO]-	276.124131	170.2
[M+CH3COO]-	290.139781	189.8
[M+Na-2H]-	252.100596	157.0
[M]+	231.12538142	149.6
[M]-	231.12647858	149.6

Literature stripe

literature stripe

Patent stripe

patents stripe