CID 24753719

Pci-34051

Structural Information

Molecular Formula

C₁₇H₁₆N₂O₃

SMILES

COC1=CC=C(C=C1)CN2C=CC3=C2C=C(C=C3)C(=O)NO

InChI

InChI=1S/C17H16N2O3/c1-22-15-6-2-12(3-7-15)11-19-9-8-13-4-5-14(10-16(13)19)17(20)18-21/h2-10,21H,11H2,1H3,(H,18,20)

InChIKey

AJRGHIGYPXNABY-UHFFFAOYSA-N

Compound name

N-hydroxy-1-[(4-methoxyphenyl)methyl]indole-6-carboxamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 76
References: 647
Patents: 296.1161 Da
Monoisotopic Mass: 2.4
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]+	297.12338	167.9
[M+Na]+	319.10532	181.5
[M+NH4]+	314.14992	175.3
[M+K]+	335.07926	176.4
[M-H]-	295.10882	171.5
[M+Na-2H]-	317.09077	175.4
[M]+	296.11555	170.8
[M]-	296.11665	170.8

Literature stripe

literature stripe

Patent stripe

patents stripe