CID 69292156

96894-67-6

Structural Information

Molecular Formula

C₆H₁₃NO₂

SMILES

CC1(OC[C@@H](O1)NC)C

InChI

InChI=1S/C6H13NO2/c1-6(2)8-4-5(7-3)9-6/h5,7H,4H2,1-3H3/t5-/m1/s1

InChIKey

KSUOODHGNBDGGQ-RXMQYKEDSA-N

Compound name

(4R)-N,2,2-trimethyl-1,3-dioxolan-4-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 16
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]+	132.101916	125.0
[M+Na]+	154.083858	132.4
[M-H]-	130.087364	130.0
[M+NH4]+	149.128463	148.0
[M+K]+	170.057798	134.7
[M+H-H2O]+	114.091900	121.1
[M+HCOO]-	176.092841	147.8
[M+CH3COO]-	190.108491	172.7
[M+Na-2H]-	152.069306	133.4
[M]+	131.09409142	125.6
[M]-	131.09518858	125.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe