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2,3-Dihydro-1H-6-(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)carbonyl-1,4-diazepine
SpectraBase Compound ID CYXWOIK9kUN
InChI InChI=1S/C16H16N2O5/c1-21-14-10-3-6-23-15(10)16(22-2)13(20)11(14)12(19)9-7-17-4-5-18-8-9/h3,6-8,17,20H,4-5H2,1-2H3
InChIKey NMCRHYGMUJXZFF-UHFFFAOYSA-N
Mol Weight 316.31 g/mol
Molecular Formula C16H16N2O5
Exact Mass 316.105922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Xe6xMwxl2
Name 2,3-Dihydro-1H-6-(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)carbonyl-1,4-diazepine
Appearance Yellow crystals
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16N2O5
InChI InChI=1S/C16H16N2O5/c1-21-14-10-3-6-23-15(10)16(22-2)13(20)11(14)12(19)9-7-17-4-5-18-8-9/h3,6-8,17,20H,4-5H2,1-2H3
InChIKey NMCRHYGMUJXZFF-UHFFFAOYSA-N
Instrument Name Shimadzu GC-2010
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2733
Molecular Weight 316.313 g/mol
SMILES Oc1c(c2c(c(c1C(C1=CNCCN=C1)=O)OC)cco2)OC
SPLASH splash10-0600-2492000000-41804ca1ebee05d53314
Source of Spectrum Y-54-1476-27
Wiley ID 1878243