For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1,3,3a,10a-Tetrahydrobenzo[e]cyclopenta[b][1,4]dioxepin-9(2H)-one
SpectraBase Compound ID 4ZWrZ9Laymb
InChI InChI=1S/C12H12O3/c13-12-8-4-1-2-5-9(8)14-10-6-3-7-11(10)15-12/h1-2,4-5,10-11H,3,6-7H2
InChIKey CUGURPHEQUZWEC-UHFFFAOYSA-N
Mol Weight 204.22 g/mol
Molecular Formula C12H12O3
Exact Mass 204.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 1WjgMMJGZ9o
Name 1,3,3a,10a-Tetrahydrobenzo[e]cyclopenta[b][1,4]dioxepin-9(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O3
InChI InChI=1S/C12H12O3/c13-12-8-4-1-2-5-9(8)14-10-6-3-7-11(10)15-12/h1-2,4-5,10-11H,3,6-7H2
InChIKey CUGURPHEQUZWEC-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c3cc48490d
Molecular Weight 204.225 g/mol
SMILES c1ccc2OC3C(OC(=O)c2c1)CCC3
SPLASH splash10-0f6t-0930000000-69a3543ad86172811457
Source of Spectrum KD-50-2114/SM-3e
Wiley ID 1754331