CID 76893

2-aminophenanthrene

Structural Information

Molecular Formula

C₁₄H₁₁N

SMILES

C1=CC=C2C(=C1)C=CC3=C2C=CC(=C3)N

InChI

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

InChIKey

ZEAWSFHWVLOENK-UHFFFAOYSA-N

Compound name

phenanthren-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 290
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