CID 7676

2-ethoxy-3,4-dihydro-2h-pyran

Structural Information

Molecular Formula

C₇H₁₂O₂

SMILES

CCOC1CCC=CO1

InChI

InChI=1S/C7H12O2/c1-2-8-7-5-3-4-6-9-7/h4,6-7H,2-3,5H2,1H3

InChIKey

VZJFPIXCMVSTID-UHFFFAOYSA-N

Compound name

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

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 0
References: 597
Patents: 128.08372 Da
Monoisotopic Mass: 1.5
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]+	129.09100	124.7
[M+Na]+	151.07294	136.8
[M+NH4]+	146.11754	134.0
[M+K]+	167.04688	130.9
[M-H]-	127.07644	128.2
[M+Na-2H]-	149.05839	131.0
[M]+	128.08317	127.4
[M]-	128.08427	127.4

Literature stripe

literature stripe

Patent stripe

patents stripe