CID 22020678

2137765-72-9

Structural Information

Molecular Formula

C₁₀H₂₁N

SMILES

CC(C)C1CCC(N1)C(C)C

InChI

InChI=1S/C10H21N/c1-7(2)9-5-6-10(11-9)8(3)4/h7-11H,5-6H2,1-4H3

InChIKey

CITAJXRBKWJHJR-UHFFFAOYSA-N

Compound name

2,5-di(propan-2-yl)pyrrolidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 360
Patents: 155.1674 Da
Monoisotopic Mass: 3.1
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]+	156.17468	140.4
[M+Na]+	178.15662	145.3
[M-H]-	154.16012	140.6
[M+NH4]+	173.20122	161.3
[M+K]+	194.13056	143.9
[M+H-H2O]+	138.16466	134.7
[M+HCOO]-	200.16560	157.6
[M+CH3COO]-	214.18125	178.1
[M+Na-2H]-	176.14207	140.0
[M]+	155.16685	136.2
[M]-	155.16795	136.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe