CID 18772

2-(p-isobutylphenyl)acetohydroxamic acid

Structural Information

Molecular Formula

C₁₂H₁₇NO₂

SMILES

CC(C)CC1=CC=C(C=C1)CC(=O)NO

InChI

InChI=1S/C12H17NO2/c1-9(2)7-10-3-5-11(6-4-10)8-12(14)13-15/h3-6,9,15H,7-8H2,1-2H3,(H,13,14)

InChIKey

KXWBJMRKTBNVNY-UHFFFAOYSA-N

Compound name

N-hydroxy-2-[4-(2-methylpropyl)phenyl]acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 7
Patents: 207.12593 Da
Monoisotopic Mass: 2.2
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]+	208.133206	148.2
[M+Na]+	230.115148	153.7
[M-H]-	206.118654	150.3
[M+NH4]+	225.159753	166.2
[M+K]+	246.089088	151.6
[M+H-H2O]+	190.123190	142.0
[M+HCOO]-	252.124131	170.0
[M+CH3COO]-	266.139781	188.0
[M+Na-2H]-	228.100596	151.3
[M]+	207.12538142	147.7
[M]-	207.12647858	147.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe