CID 71756738

1423031-68-8

Structural Information

Molecular Formula

C₁₀H₁₃NO₂

SMILES

COC1CCOC2=C1C=CC=C2N

InChI

InChI=1S/C10H13NO2/c1-12-9-5-6-13-10-7(9)3-2-4-8(10)11/h2-4,9H,5-6,11H2,1H3

InChIKey

JRGWJSOEYJKQNW-UHFFFAOYSA-N

Compound name

4-methoxy-3,4-dihydro-2H-chromen-8-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 179.09464 Da
Monoisotopic Mass: 1.0
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]+	180.101916	136.1
[M+Na]+	202.083858	143.6
[M-H]-	178.087364	140.9
[M+NH4]+	197.128463	155.7
[M+K]+	218.057798	142.7
[M+H-H2O]+	162.091900	130.1
[M+HCOO]-	224.092841	157.4
[M+CH3COO]-	238.108491	183.0
[M+Na-2H]-	200.069306	143.9
[M]+	179.09409142	134.9
[M]-	179.09518858	134.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.