CID 204472

Brn 2081711

Structural Information

Molecular Formula

C₁₁H₁₉N

SMILES

CN(CC1CCC=CC1)C2CC2

InChI

InChI=1S/C11H19N/c1-12(11-7-8-11)9-10-5-3-2-4-6-10/h2-3,10-11H,4-9H2,1H3

InChIKey

VIIIDLFTVQKCBK-UHFFFAOYSA-N

Compound name

N-(cyclohex-3-en-1-ylmethyl)-N-methylcyclopropanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 165.15175 Da
Monoisotopic Mass: 2.6
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]+	166.159026	136.4
[M+Na]+	188.140968	142.2
[M-H]-	164.144474	144.4
[M+NH4]+	183.185573	152.3
[M+K]+	204.114908	141.0
[M+H-H2O]+	148.149010	129.3
[M+HCOO]-	210.149951	159.6
[M+CH3COO]-	224.165601	188.1
[M+Na-2H]-	186.126416	141.9
[M]+	165.15120142	135.9
[M]-	165.15229858	135.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.