CID 14360898

10419-35-9

Structural Information

Molecular Formula

C₁₁H₁₄O₂

SMILES

CCOC1CCC2=CC=CC=C2O1

InChI

InChI=1S/C11H14O2/c1-2-12-11-8-7-9-5-3-4-6-10(9)13-11/h3-6,11H,2,7-8H2,1H3

InChIKey

RPALXIFLOLAXEQ-UHFFFAOYSA-N

Compound name

2-ethoxy-3,4-dihydro-2H-chromene

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 5
Patents: 178.09938 Da
Monoisotopic Mass: 2.7
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]+	179.10666	136.0
[M+Na]+	201.08860	143.0
[M-H]-	177.09210	140.8
[M+NH4]+	196.13320	156.0
[M+K]+	217.06254	142.3
[M+H-H2O]+	161.09664	130.0
[M+HCOO]-	223.09758	156.6
[M+CH3COO]-	237.11323	180.6
[M+Na-2H]-	199.07405	144.7
[M]+	178.09883	136.4
[M]-	178.09993	136.4

Literature stripe

literature stripe

Patent stripe

patents stripe