CID 80153

6053-81-2

Structural Information

Molecular Formula

C₆H₁₃N

SMILES

C1CCC(C1)CN

InChI

InChI=1S/C6H13N/c7-5-6-3-1-2-4-6/h6H,1-5,7H2

InChIKey

UBLYEVLMRSPMOG-UHFFFAOYSA-N

Compound name

cyclopentylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 3142
Patents: 99.1048 Da
Monoisotopic Mass: 1.1
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]+	100.11208	121.0
[M+Na]+	122.09402	126.6
[M-H]-	98.097524	123.6
[M+NH4]+	117.13862	145.2
[M+K]+	138.06796	125.8
[M+H-H2O]+	82.102060	115.8
[M+HCOO]-	144.10300	144.6
[M+CH3COO]-	158.11865	167.3
[M+Na-2H]-	120.07947	125.7
[M]+	99.104251	115.7
[M]-	99.105349	115.7

Literature stripe

literature stripe

Patent stripe

patents stripe