CID 10654304

80842-67-7

Structural Information

Molecular Formula

C₈H₁₆N₂

SMILES

C1CC2(CCCN2C1)CN

InChI

InChI=1S/C8H16N2/c9-7-8-3-1-5-10(8)6-2-4-8/h1-7,9H2

InChIKey

YSMMVKXAJZFXHK-UHFFFAOYSA-N

Compound name

1,2,3,5,6,7-hexahydropyrrolizin-8-ylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 91
Patents: 140.13135 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]+	141.138626	131.7
[M+Na]+	163.120568	137.8
[M-H]-	139.124074	133.7
[M+NH4]+	158.165173	157.6
[M+K]+	179.094508	136.1
[M+H-H2O]+	123.128610	126.0
[M+HCOO]-	185.129551	152.7
[M+CH3COO]-	199.145201	144.6
[M+Na-2H]-	161.106016	135.9
[M]+	140.13080142	126.2
[M]-	140.13189858	126.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe