CID 16733

1-amino-2-methylnaphthalene

Structural Information

Molecular Formula

C₁₁H₁₁N

SMILES

CC1=C(C2=CC=CC=C2C=C1)N

InChI

InChI=1S/C11H11N/c1-8-6-7-9-4-2-3-5-10(9)11(8)12/h2-7H,12H2,1H3

InChIKey

JMBLSGAXSMOKPN-UHFFFAOYSA-N

Compound name

2-methylnaphthalen-1-amine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 2
References: 589
Patents: 157.08914 Da
Monoisotopic Mass: 2.9
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]+	158.09642	131.0
[M+Na]+	180.07836	145.9
[M+NH4]+	175.12296	141.8
[M+K]+	196.05230	137.8
[M-H]-	156.08186	135.9
[M+Na-2H]-	178.06381	139.8
[M]+	157.08859	134.7
[M]-	157.08969	134.7

Literature stripe

literature stripe

Patent stripe

patents stripe