CID 21683211

1020937-75-0

Structural Information

Molecular Formula

C₉H₂₀N₂

SMILES

CC(C)C(CN1CCCC1)N

InChI

InChI=1S/C9H20N2/c1-8(2)9(10)7-11-5-3-4-6-11/h8-9H,3-7,10H2,1-2H3

InChIKey

YFGHMMMMWUCNNO-UHFFFAOYSA-N

Compound name

3-methyl-1-pyrrolidin-1-ylbutan-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 13
Patents: 156.16264 Da
Monoisotopic Mass: 1.2
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]+	157.16992	140.3
[M+Na]+	179.15186	144.1
[M-H]-	155.15536	141.0
[M+NH4]+	174.19646	160.8
[M+K]+	195.12580	143.4
[M+H-H2O]+	139.15990	133.5
[M+HCOO]-	201.16084	159.6
[M+CH3COO]-	215.17649	180.7
[M+Na-2H]-	177.13731	140.8
[M]+	156.16209	135.3
[M]-	156.16319	135.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe