CID 20724840

1147181-18-7

Structural Information

Molecular Formula

C₁₀H₁₅N₃O

SMILES

C1COCCN1CC2=NC=C(C=C2)N

InChI

InChI=1S/C10H15N3O/c11-9-1-2-10(12-7-9)8-13-3-5-14-6-4-13/h1-2,7H,3-6,8,11H2

InChIKey

VRPTWRNDKCCMHW-UHFFFAOYSA-N

Compound name

6-(morpholin-4-ylmethyl)pyridin-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 125
Patents: 193.1215 Da
Monoisotopic Mass: -0.3
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]+	194.12878	143.6
[M+Na]+	216.11072	149.1
[M-H]-	192.11422	146.9
[M+NH4]+	211.15532	158.1
[M+K]+	232.08466	147.4
[M+H-H2O]+	176.11876	134.6
[M+HCOO]-	238.11970	162.1
[M+CH3COO]-	252.13535	154.9
[M+Na-2H]-	214.09617	150.2
[M]+	193.12095	138.7
[M]-	193.12205	138.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe