CID 19045189

1157076-33-9

Structural Information

Molecular Formula

C₅H₁₂N₂O

SMILES

C1COCC(N1)CN

InChI

InChI=1S/C5H12N2O/c6-3-5-4-8-2-1-7-5/h5,7H,1-4,6H2

InChIKey

VLHGVSGPYXDAKS-UHFFFAOYSA-N

Compound name

morpholin-3-ylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 249
Patents: 116.09496 Da
Monoisotopic Mass: -1.5
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]+	117.102236	124.5
[M+Na]+	139.084178	129.2
[M-H]-	115.087684	124.7
[M+NH4]+	134.128783	142.8
[M+K]+	155.058118	128.9
[M+H-H2O]+	99.092220	118.2
[M+HCOO]-	161.093161	142.8
[M+CH3COO]-	175.108811	166.4
[M+Na-2H]-	137.069626	131.4
[M]+	116.09441142	117.5
[M]-	116.09550858	117.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe