CID 61350941

3-[3-(methylamino)propyl]-1,3-oxazolidin-2-one hydrochloride

Structural Information

Molecular Formula

C₇H₁₄N₂O₂

SMILES

CNCCCN1CCOC1=O

InChI

InChI=1S/C7H14N2O2/c1-8-3-2-4-9-5-6-11-7(9)10/h8H,2-6H2,1H3

InChIKey

MIPNVRSJBXUAIF-UHFFFAOYSA-N

Compound name

3-[3-(methylamino)propyl]-1,3-oxazolidin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 158.10553 Da
Monoisotopic Mass: -0.2
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]+	159.112806	133.9
[M+Na]+	181.094748	140.2
[M-H]-	157.098254	136.2
[M+NH4]+	176.139353	153.5
[M+K]+	197.068688	140.5
[M+H-H2O]+	141.102790	127.4
[M+HCOO]-	203.103731	156.2
[M+CH3COO]-	217.119381	177.8
[M+Na-2H]-	179.080196	139.3
[M]+	158.10498142	133.7
[M]-	158.10607858	133.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe