CID 47200

64058-97-5

Structural Information

Molecular Formula

C₁₄H₂₂N₂O

SMILES

CCCCN=C(C(C1=CC=CC=C1)OCC)N

InChI

InChI=1S/C14H22N2O/c1-3-5-11-16-14(15)13(17-4-2)12-9-7-6-8-10-12/h6-10,13H,3-5,11H2,1-2H3,(H2,15,16)

InChIKey

KTUZEYASKOEGNO-UHFFFAOYSA-N

Compound name

N'-butyl-2-ethoxy-2-phenylethanimidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 234.17322 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]+	235.18050	158.5
[M+Na]+	257.16244	162.2
[M-H]-	233.16594	162.0
[M+NH4]+	252.20704	175.9
[M+K]+	273.13638	160.4
[M+H-H2O]+	217.17048	150.8
[M+HCOO]-	279.17142	182.7
[M+CH3COO]-	293.18707	200.3
[M+Na-2H]-	255.14789	161.4
[M]+	234.17267	158.9
[M]-	234.17377	158.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe