CID 67048

N-allylsalicylamide

Structural Information

Molecular Formula

C₁₀H₁₁NO₂

SMILES

C=CCNC(=O)C1=CC=CC=C1O

InChI

InChI=1S/C10H11NO2/c1-2-7-11-10(13)8-5-3-4-6-9(8)12/h2-6,12H,1,7H2,(H,11,13)

InChIKey

IECWHJOALGVHPA-UHFFFAOYSA-N

Compound name

2-hydroxy-N-prop-2-enylbenzamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 81
Patents: 177.07898 Da
Monoisotopic Mass: 2.0
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]+	178.086256	137.2
[M+Na]+	200.068198	144.2
[M-H]-	176.071704	139.6
[M+NH4]+	195.112803	156.4
[M+K]+	216.042138	141.4
[M+H-H2O]+	160.076240	131.4
[M+HCOO]-	222.077181	160.8
[M+CH3COO]-	236.092831	180.2
[M+Na-2H]-	198.053646	142.7
[M]+	177.07843142	136.0
[M]-	177.07952858	136.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe