CID 80828

9,10-anthracenedione, 1-hydrazinyl-

Structural Information

Molecular Formula

C₁₄H₁₀N₂O₂

SMILES

C1=CC=C2C(=C1)C(=C3C=CC=C(C3=C2O)N=N)O

InChI

InChI=1S/C14H10N2O2/c15-16-11-7-3-6-10-12(11)14(18)9-5-2-1-4-8(9)13(10)17/h1-7,15,17-18H

InChIKey

FHPDENYDPSUOSF-UHFFFAOYSA-N

Compound name

1-diazenylanthracene-9,10-diol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 43
Patents: 238.07423 Da
Monoisotopic Mass: 4.4
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]+	239.08151	146.8
[M+Na]+	261.06345	157.6
[M-H]-	237.06695	152.3
[M+NH4]+	256.10805	165.9
[M+K]+	277.03739	152.6
[M+H-H2O]+	221.07149	140.2
[M+HCOO]-	283.07243	171.9
[M+CH3COO]-	297.08808	160.4
[M+Na-2H]-	259.04890	157.5
[M]+	238.07368	148.1
[M]-	238.07478	148.1

Literature stripe

literature stripe

Patent stripe

patents stripe