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3,4,6,7,9,10,12,13-octahydro-2,5,8,11,14-benzopentaoxacycloheptadecin-1,15-dione
SpectraBase Compound ID 2w60HkijOdQ
InChI InChI=1S/C16H20O7/c17-15-13-3-1-2-4-14(13)16(18)23-12-10-21-8-6-19-5-7-20-9-11-22-15/h1-4H,5-12H2
InChIKey KDBZUZMNHKRLQL-UHFFFAOYSA-N
Mol Weight 324.33 g/mol
Molecular Formula C16H20O7
Exact Mass 324.120903 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ds20rxRcLNl
Name 3,4,6,7,9,10,12,13-octahydro-2,5,8,11,14-benzopentaoxacycloheptadecin-1,15-dione
Alternate Name(s) 3,6,9,12,15-pentaoxabicyclo[15.4.0]heneicosa-1(21),17,19-triene-2,16-dione 3,6,9,12,15-pentaoxabicyclo[15.4.0]heneicosa-1(21),17,19-triene-2,16-quinone 3,6,9,12,15-pentaoxabicyclo[15.4.0]henicosa-1(21),17,19-triene-2,16-dione
CAS Registry Number 21161-08-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O7
InChI InChI=1S/C16H20O7/c17-15-13-3-1-2-4-14(13)16(18)23-12-10-21-8-6-19-5-7-20-9-11-22-15/h1-4H,5-12H2
InChIKey KDBZUZMNHKRLQL-UHFFFAOYSA-N
Molecular Weight 324.329 g/mol
SMILES C1(c2c(C(OCCOCCOCCOCCO1)=O)cccc2)=O
SPLASH splash10-0002-0900000000-a5dab0b0fdc282a193e3
Source of Spectrum O-21-396-1
Wiley ID 1323033