CID 6878382

292180-82-6

Structural Information

Molecular Formula

C₁₄H₁₄N₂O₂

SMILES

CCC1=CC=C(C=C1)/C=N/NC(=O)C2=CC=CO2

InChI

InChI=1S/C14H14N2O2/c1-2-11-5-7-12(8-6-11)10-15-16-14(17)13-4-3-9-18-13/h3-10H,2H2,1H3,(H,16,17)/b15-10+

InChIKey

CGMGNIOCRGKDNT-XNTDXEJSSA-N

Compound name

N-[(E)-(4-ethylphenyl)methylideneamino]furan-2-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 242.10553 Da
Monoisotopic Mass: 3.0
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]+	243.112806	155.2
[M+Na]+	265.094748	161.8
[M-H]-	241.098254	164.1
[M+NH4]+	260.139353	173.0
[M+K]+	281.068688	160.1
[M+H-H2O]+	225.102790	147.5
[M+HCOO]-	287.103731	182.9
[M+CH3COO]-	301.119381	197.4
[M+Na-2H]-	263.080196	160.9
[M]+	242.10498142	157.2
[M]-	242.10607858	157.2

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.