CID 218427

2-oxazoline, 2-(4-methoxy-1-naphthylamino)-

Structural Information

Molecular Formula

C₁₄H₁₄N₂O₂

SMILES

COC1=CC=C(C2=CC=CC=C21)NC3=NCCO3

InChI

InChI=1S/C14H14N2O2/c1-17-13-7-6-12(16-14-15-8-9-18-14)10-4-2-3-5-11(10)13/h2-7H,8-9H2,1H3,(H,15,16)

InChIKey

USNWROZXFWKCEX-UHFFFAOYSA-N

Compound name

N-(4-methoxynaphthalen-1-yl)-4,5-dihydro-1,3-oxazol-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 242.10553 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]+	243.112806	151.9
[M+Na]+	265.094748	160.0
[M-H]-	241.098254	159.1
[M+NH4]+	260.139353	169.3
[M+K]+	281.068688	157.5
[M+H-H2O]+	225.102790	144.1
[M+HCOO]-	287.103731	174.8
[M+CH3COO]-	301.119381	164.9
[M+Na-2H]-	263.080196	159.2
[M]+	242.10498142	153.1
[M]-	242.10607858	153.1

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.