CID 776851

4-(morpholinomethyl)aniline

Structural Information

Molecular Formula

C₁₁H₁₆N₂O

SMILES

C1COCCN1CC2=CC=C(C=C2)N

InChI

InChI=1S/C11H16N2O/c12-11-3-1-10(2-4-11)9-13-5-7-14-8-6-13/h1-4H,5-9,12H2

InChIKey

WNYFVEFUHMDIRQ-UHFFFAOYSA-N

Compound name

4-(morpholin-4-ylmethyl)aniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 8
References: 1133
Patents: 192.12627 Da
Monoisotopic Mass: 0.9
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]+	193.13355	143.7
[M+Na]+	215.11549	156.1
[M+NH4]+	210.16009	152.6
[M+K]+	231.08943	149.4
[M-H]-	191.11899	149.5
[M+Na-2H]-	213.10094	151.1
[M]+	192.12572	147.0
[M]-	192.12682	147.0

Literature stripe

literature stripe

Patent stripe

patents stripe