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3,4-Dihydro-3-[(tetrahydro-2H-pyran-2-yl)oxy]-2H-1,5-benzodioxepine
SpectraBase Compound ID 4w2HmfSct9N
InChI InChI=1S/C14H18O4/c1-2-6-13-12(5-1)16-9-11(10-17-13)18-14-7-3-4-8-15-14/h1-2,5-6,11,14H,3-4,7-10H2
InChIKey MSBKOYPCJKINOV-UHFFFAOYSA-N
Mol Weight 250.29 g/mol
Molecular Formula C14H18O4
Exact Mass 250.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6nRpPiV0Nxa
Name 3,4-Dihydro-3-[(tetrahydro-2H-pyran-2-yl)oxy]-2H-1,5-benzodioxepine
Alternate Name(s) 3-((tetrahydro-2H-pyran-2-yl)oxy)-3,4-dihydro-2H-benzo[b][1,4]dioxepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O4
InChI InChI=1S/C14H18O4/c1-2-6-13-12(5-1)16-9-11(10-17-13)18-14-7-3-4-8-15-14/h1-2,5-6,11,14H,3-4,7-10H2
InChIKey MSBKOYPCJKINOV-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.200790085
Molecular Weight 250.294 g/mol
SMILES c1cc2c(cc1)OCC(CO2)OC1CCCCO1
SPLASH splash10-000i-9520000000-c9ce97ce062660556a55
Source of Spectrum H-90-1022-26c
Wiley ID 1783866