CID 3610719

1-cyclopropylhexan-1-amine hydrochloride

Structural Information

Molecular Formula

C₉H₁₉N

SMILES

CCCCCC(C1CC1)N

InChI

InChI=1S/C9H19N/c1-2-3-4-5-9(10)8-6-7-8/h8-9H,2-7,10H2,1H3

InChIKey

VNFNTNRETQRVCA-UHFFFAOYSA-N

Compound name

1-cyclopropylhexan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 141.15175 Da
Monoisotopic Mass: 2.4
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]+	142.159026	132.1
[M+Na]+	164.140968	139.1
[M-H]-	140.144474	135.9
[M+NH4]+	159.185573	148.5
[M+K]+	180.114908	136.9
[M+H-H2O]+	124.149010	126.0
[M+HCOO]-	186.149951	154.9
[M+CH3COO]-	200.165601	183.0
[M+Na-2H]-	162.126416	136.5
[M]+	141.15120142	133.4
[M]-	141.15229858	133.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe