CID 108878

60043-08-5

Structural Information

Molecular Formula

C₁₆H₂₅NO₂

SMILES

CC(=O)NC1=CC(=CC(=C1O)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C16H25NO2/c1-10(18)17-13-9-11(15(2,3)4)8-12(14(13)19)16(5,6)7/h8-9,19H,1-7H3,(H,17,18)

InChIKey

CHAOLRKYRZZMKR-UHFFFAOYSA-N

Compound name

N-(3,5-ditert-butyl-2-hydroxyphenyl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 263.18854 Da
Monoisotopic Mass: 4.1
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]+	264.19582	163.4
[M+Na]+	286.17776	170.4
[M-H]-	262.18126	166.3
[M+NH4]+	281.22236	180.3
[M+K]+	302.15170	168.1
[M+H-H2O]+	246.18580	158.5
[M+HCOO]-	308.18674	181.7
[M+CH3COO]-	322.20239	201.2
[M+Na-2H]-	284.16321	166.3
[M]+	263.18799	164.7
[M]-	263.18909	164.7

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.