CID 109078

61385-78-2

Structural Information

Molecular Formula

C₁₀H₂₁N

SMILES

CCC(CC)C=NCC(C)C

InChI

InChI=1S/C10H21N/c1-5-10(6-2)8-11-7-9(3)4/h8-10H,5-7H2,1-4H3

InChIKey

JOBMTFGMACYEIF-UHFFFAOYSA-N

Compound name

2-ethyl-N-(2-methylpropyl)butan-1-imine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 155.1674 Da
Monoisotopic Mass: 2.9
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]+	156.17468	140.4
[M+Na]+	178.15662	145.5
[M-H]-	154.16012	141.7
[M+NH4]+	173.20122	162.1
[M+K]+	194.13056	145.5
[M+H-H2O]+	138.16466	135.0
[M+HCOO]-	200.16560	163.7
[M+CH3COO]-	214.18125	187.0
[M+Na-2H]-	176.14207	143.6
[M]+	155.16685	142.3
[M]-	155.16795	142.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe