CID 19691485

1251006-82-2

Structural Information

Molecular Formula

C₁₃H₂₄N₂O₂

SMILES

CC(C)(C)OC(=O)N1CCCC1C2CCNC2

InChI

InChI=1S/C13H24N2O2/c1-13(2,3)17-12(16)15-8-4-5-11(15)10-6-7-14-9-10/h10-11,14H,4-9H2,1-3H3

InChIKey

SWXKQKRTYYRLEM-UHFFFAOYSA-N

Compound name

tert-butyl 2-pyrrolidin-3-ylpyrrolidine-1-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 240.18378 Da
Monoisotopic Mass: 1.6
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]+	241.19106	161.7
[M+Na]+	263.17300	165.4
[M-H]-	239.17650	163.5
[M+NH4]+	258.21760	179.3
[M+K]+	279.14694	163.8
[M+H-H2O]+	223.18104	154.7
[M+HCOO]-	285.18198	176.1
[M+CH3COO]-	299.19763	187.1
[M+Na-2H]-	261.15845	159.8
[M]+	240.18323	156.7
[M]-	240.18433	156.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe