CID 15316547

112395-73-0

Structural Information

Molecular Formula

C₇H₁₅NO₂

SMILES

C[C@H]([C@H]1COC(O1)(C)C)N

InChI

InChI=1S/C7H15NO2/c1-5(8)6-4-9-7(2,3)10-6/h5-6H,4,8H2,1-3H3/t5-,6-/m1/s1

InChIKey

IGVMHZDCIZWZGY-PHDIDXHHSA-N

Compound name

(1R)-1-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 23
Patents: 145.11028 Da
Monoisotopic Mass: 0.0
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]+	146.11756	131.2
[M+Na]+	168.09950	138.0
[M-H]-	144.10300	135.6
[M+NH4]+	163.14410	153.3
[M+K]+	184.07344	140.1
[M+H-H2O]+	128.10754	127.2
[M+HCOO]-	190.10848	152.0
[M+CH3COO]-	204.12413	175.9
[M+Na-2H]-	166.08495	136.7
[M]+	145.10973	130.5
[M]-	145.11083	130.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe