CID 209160

N,n-diethyl-2-hydroxy-4-methoxybenzamide

Structural Information

Molecular Formula

C₁₂H₁₇NO₃

SMILES

CCN(CC)C(=O)C1=CC(=C(C=C1)OC)O

InChI

InChI=1S/C12H17NO3/c1-4-13(5-2)12(15)9-6-7-11(16-3)10(14)8-9/h6-8,14H,4-5H2,1-3H3

InChIKey

FFLBZJBCSKGBBK-UHFFFAOYSA-N

Compound name

N,N-diethyl-3-hydroxy-4-methoxybenzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 223.12085 Da
Monoisotopic Mass: 2.1
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]+	224.128126	149.9
[M+Na]+	246.110068	156.8
[M-H]-	222.113574	153.8
[M+NH4]+	241.154673	168.3
[M+K]+	262.084008	156.1
[M+H-H2O]+	206.118110	143.5
[M+HCOO]-	268.119051	173.4
[M+CH3COO]-	282.134701	193.9
[M+Na-2H]-	244.095516	153.0
[M]+	223.12030142	153.3
[M]-	223.12139858	153.3

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.