CID 17750175

204452-90-4

Structural Information

Molecular Formula

C₁₁H₁₂N₂O₂

SMILES

COC(C1=NC2=C(C=CC=N2)C=C1)OC

InChI

InChI=1S/C11H12N2O2/c1-14-11(15-2)9-6-5-8-4-3-7-12-10(8)13-9/h3-7,11H,1-2H3

InChIKey

SVSHWQZULQIOEI-UHFFFAOYSA-N

Compound name

2-(dimethoxymethyl)-1,8-naphthyridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 132
Patents: 204.08987 Da
Monoisotopic Mass: 1.1
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]+	205.097146	143.1
[M+Na]+	227.079088	151.6
[M-H]-	203.082594	144.9
[M+NH4]+	222.123693	160.4
[M+K]+	243.053028	149.6
[M+H-H2O]+	187.087130	135.0
[M+HCOO]-	249.088071	163.7
[M+CH3COO]-	263.103721	186.2
[M+Na-2H]-	225.064536	151.7
[M]+	204.08932142	146.1
[M]-	204.09041858	146.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe