CID 17997280

3-(1,3-dioxolan-2-yl)pyrrolidine hydrochloride

Structural Information

Molecular Formula

C₇H₁₃NO₂

SMILES

C1CNCC1C2OCCO2

InChI

InChI=1S/C7H13NO2/c1-2-8-5-6(1)7-9-3-4-10-7/h6-8H,1-5H2

InChIKey

QBSBYAALKGKPDS-UHFFFAOYSA-N

Compound name

3-(1,3-dioxolan-2-yl)pyrrolidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 143.09464 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]+	144.101916	129.7
[M+Na]+	166.083858	134.5
[M-H]-	142.087364	133.9
[M+NH4]+	161.128463	149.3
[M+K]+	182.057798	135.7
[M+H-H2O]+	126.091900	124.1
[M+HCOO]-	188.092841	147.8
[M+CH3COO]-	202.108491	142.5
[M+Na-2H]-	164.069306	133.5
[M]+	143.09409142	124.8
[M]-	143.09518858	124.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe