CID 154532264

2445791-67-1

Structural Information

Molecular Formula

C₁₁H₂₃N

SMILES

C1CC1CCCCCCCCN

InChI

InChI=1S/C11H23N/c12-10-6-4-2-1-3-5-7-11-8-9-11/h11H,1-10,12H2

InChIKey

OLUOAVLMDUWCNV-UHFFFAOYSA-N

Compound name

8-cyclopropyloctan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 169.18304 Da
Monoisotopic Mass: 3.8
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]+	170.190316	140.3
[M+Na]+	192.172258	146.7
[M-H]-	168.175764	143.7
[M+NH4]+	187.216863	155.7
[M+K]+	208.146198	143.6
[M+H-H2O]+	152.180300	133.8
[M+HCOO]-	214.181241	163.5
[M+CH3COO]-	228.196891	188.0
[M+Na-2H]-	190.157706	144.9
[M]+	169.18249142	142.9
[M]-	169.18358858	142.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.