CID 21975567

2-(n-methyl-2-aminoethyl)-1,3-dioxolane

Structural Information

Molecular Formula

C₆H₁₃NO₂

SMILES

CNCCC1OCCO1

InChI

InChI=1S/C6H13NO2/c1-7-3-2-6-8-4-5-9-6/h6-7H,2-5H2,1H3

InChIKey

ZUUQKDDUUOFCNP-UHFFFAOYSA-N

Compound name

2-(1,3-dioxolan-2-yl)-N-methylethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 176
Patents: 131.09464 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]+	132.10192	127.2
[M+Na]+	154.08386	136.5
[M+NH4]+	149.12846	135.6
[M+K]+	170.05780	133.7
[M-H]-	130.08736	131.2
[M+Na-2H]-	152.06931	130.8
[M]+	131.09409	129.4
[M]-	131.09519	129.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe