CID 637524

3-hydroxy-n,n-dimethylbenzamide

Structural Information

Molecular Formula

C₉H₁₁NO₂

SMILES

CN(C)C(=O)C1=CC(=CC=C1)O

InChI

InChI=1S/C9H11NO2/c1-10(2)9(12)7-4-3-5-8(11)6-7/h3-6,11H,1-2H3

InChIKey

TULKODADVOEVTR-UHFFFAOYSA-N

Compound name

3-hydroxy-N,N-dimethylbenzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 110
Patents: 165.07898 Da
Monoisotopic Mass: 1.4
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]+	166.086256	133.5
[M+Na]+	188.068198	140.8
[M-H]-	164.071704	137.6
[M+NH4]+	183.112803	153.9
[M+K]+	204.042138	140.3
[M+H-H2O]+	148.076240	127.7
[M+HCOO]-	210.077181	157.8
[M+CH3COO]-	224.092831	181.5
[M+Na-2H]-	186.053646	138.8
[M]+	165.07843142	133.8
[M]-	165.07952858	133.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe