CID 89153395

869292-48-8

Structural Information

Molecular Formula

C₇H₁₆N₂

SMILES

CC1(CNCC1CN)C

InChI

InChI=1S/C7H16N2/c1-7(2)5-9-4-6(7)3-8/h6,9H,3-5,8H2,1-2H3

InChIKey

YTNNHLLAJGNGCE-UHFFFAOYSA-N

Compound name

(4,4-dimethylpyrrolidin-3-yl)methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 128.13135 Da
Monoisotopic Mass: 0.1
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]+	129.138626	128.8
[M+Na]+	151.120568	135.4
[M-H]-	127.124074	129.1
[M+NH4]+	146.165173	152.2
[M+K]+	167.094508	133.5
[M+H-H2O]+	111.128610	123.8
[M+HCOO]-	173.129551	149.4
[M+CH3COO]-	187.145201	170.9
[M+Na-2H]-	149.106016	133.0
[M]+	128.13080142	123.2
[M]-	128.13189858	123.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe