CID 11937

2-aminoanthracene

Structural Information

Molecular Formula

C₁₄H₁₁N

SMILES

C1=CC=C2C=C3C=C(C=CC3=CC2=C1)N

InChI

InChI=1S/C14H11N/c15-14-6-5-12-7-10-3-1-2-4-11(10)8-13(12)9-14/h1-9H,15H2

InChIKey

YCSBALJAGZKWFF-UHFFFAOYSA-N

Compound name

anthracen-2-amine

Related CIDs

2D Structure

compound 2d structure

5
Annotation Hits: 266
References: 3317
Patents: 193.08914 Da
Monoisotopic Mass: 3.5
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]+	194.09642	138.9
[M+Na]+	216.07836	156.2
[M+NH4]+	211.12296	150.5
[M+K]+	232.05230	146.5
[M-H]-	192.08186	145.1
[M+Na-2H]-	214.06381	149.3
[M]+	193.08859	143.5
[M]-	193.08969	143.5

Literature stripe

literature stripe

Patent stripe

patents stripe