CID 62725687

[1-(2-methylpropyl)cyclopentyl]methanamine

Structural Information

Molecular Formula

C₁₀H₂₁N

SMILES

CC(C)CC1(CCCC1)CN

InChI

InChI=1S/C10H21N/c1-9(2)7-10(8-11)5-3-4-6-10/h9H,3-8,11H2,1-2H3

InChIKey

CWQQEAOREYIMFN-UHFFFAOYSA-N

Compound name

[1-(2-methylpropyl)cyclopentyl]methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 155.1674 Da
Monoisotopic Mass: 2.7
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]+	156.174676	139.3
[M+Na]+	178.156618	143.9
[M-H]-	154.160124	141.6
[M+NH4]+	173.201223	163.3
[M+K]+	194.130558	142.6
[M+H-H2O]+	138.164660	134.4
[M+HCOO]-	200.165601	160.6
[M+CH3COO]-	214.181251	179.8
[M+Na-2H]-	176.142066	141.8
[M]+	155.16685142	135.1
[M]-	155.16794858	135.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe