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6-Pentyldibenzo(d,f)(1,3)dioxepine
SpectraBase Compound ID AsLqLFIZtEh
InChI InChI=1S/C18H20O2/c1-2-3-4-13-18-19-16-11-7-5-9-14(16)15-10-6-8-12-17(15)20-18/h5-12,18H,2-4,13H2,1H3
InChIKey TVJABODBLVWHHP-UHFFFAOYSA-N
Mol Weight 268.36 g/mol
Molecular Formula C18H20O2
Exact Mass 268.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2nFnaQdwigV
Name 6-Pentyldibenzo(d,f)(1,3)dioxepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O2
InChI InChI=1S/C18H20O2/c1-2-3-4-13-18-19-16-11-7-5-9-14(16)15-10-6-8-12-17(15)20-18/h5-12,18H,2-4,13H2,1H3
InChIKey TVJABODBLVWHHP-UHFFFAOYSA-N
Literature Reference DOI 10.1002/rcm.2974
Molecular Weight 268.356 g/mol
SMILES c1-2c(OC(Oc3c2cccc3)CCCCC)cccc1
SPLASH splash10-014r-1960000000-b4f704a9f3adafddb04c
Source of Spectrum RCM-21-1416-4
Synonyms 6-Pentyldibenzo[d,f][1,3]dioxepine
Wiley ID 1814432