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3,4-Dihydro-2H-1,5-benzodioxepin

View entire compound with spectra: 9 NMR, 2 FTIR, 1 Raman, and 1 MS (GC)

3,4-Dihydro-2H-1,5-benzodioxepin
SpectraBase Compound ID 4glOGGURcn4
InChI InChI=1S/C9H10O2/c1-2-5-9-8(4-1)10-6-3-7-11-9/h1-2,4-5H,3,6-7H2
InChIKey CBXMULHQEVXJDI-UHFFFAOYSA-N
Mol Weight 150.18 g/mol
Molecular Formula C9H10O2
Exact Mass 150.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8af4Fpe1lzM
Name 2H-1,5-Benzodioxepin, 3,4-dihydro-
CAS Registry Number 7216-18-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10O2
InChI InChI=1S/C9H10O2/c1-2-5-9-8(4-1)10-6-3-7-11-9/h1-2,4-5H,3,6-7H2
InChIKey CBXMULHQEVXJDI-UHFFFAOYSA-N
Molecular Weight 150.177 g/mol
SMILES c1ccc2c(c1)OCCCO2
SPLASH splash10-0uk9-9600000000-80783372dccfd31621a7
Source of Spectrum O-3-1319-4
Synonyms 3,4-Dihydro-2H-1,5-benzodioxepine 3,4-Dihydro-2H-1,4-benzodioxepin 3,4-Dihydro-2H-1,5-benzodioxepin Pyrocatechol trimethylene ether BRN 0128377
Wiley ID 10024