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2-(2-Hydroxy-3-ethoxycarbonylcyclohex-2-en-yl)-4H-2,3-dihydrobenzopyran

View entire compound with spectra: 1 MS (GC)

2-(2-Hydroxy-3-ethoxycarbonylcyclohex-2-en-yl)-4H-2,3-dihydrobenzopyran
SpectraBase Compound ID LurIKgSCR7e
InChI InChI=1S/C18H20O5/c1-2-22-18(21)13-8-5-7-12(17(13)20)16-10-14(19)11-6-3-4-9-15(11)23-16/h3-4,6,9,12,16,20H,2,5,7-8,10H2,1H3
InChIKey QHRPPFLKLNQJBJ-UHFFFAOYSA-N
Mol Weight 316.35 g/mol
Molecular Formula C18H20O5
Exact Mass 316.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J2mNotefZQE
Name 2-(2-Hydroxy-3-ethoxycarbonylcyclohex-2-en-yl)-4H-2,3-dihydrobenzopyran
Alternate Name(s) 2-(2-Hydroxy-3-ethoxycarbonylcyclohex-2,3-dien-yl)-4H-2,3-dihydrobenzopyran Ethyl 2-hydroxy-3-(4-oxo-3,4-dihydro-2H-chromen-2-yl)-1-cyclohexene-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O5
InChI InChI=1S/C18H20O5/c1-2-22-18(21)13-8-5-7-12(17(13)20)16-10-14(19)11-6-3-4-9-15(11)23-16/h3-4,6,9,12,16,20H,2,5,7-8,10H2,1H3
InChIKey QHRPPFLKLNQJBJ-UHFFFAOYSA-N
Molecular Weight 316.353 g/mol
SMILES OC1=C(C(=O)OCC)CCCC1C1Oc2ccccc2C(C1)=O
SPLASH splash10-0002-0900000000-0135c701f493648d3402
Source of Spectrum QE-0-1231-4
Wiley ID 1586679