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1,2-Benzenediol, o-(6-bromohexanoyl)-o'-cyclopentanecarbonyl-

View entire compound with spectra: 1 NMR

1,2-Benzenediol, o-(6-bromohexanoyl)-o'-cyclopentanecarbonyl-
SpectraBase Compound ID 2fVEx0XCAvg
InChI InChI=1S/C18H23BrO4/c19-13-7-1-2-12-17(20)22-15-10-5-6-11-16(15)23-18(21)14-8-3-4-9-14/h5-6,10-11,14H,1-4,7-9,12-13H2
InChIKey UNEDVXZCYZQCPT-UHFFFAOYSA-N
Mol Weight 383.28 g/mol
Molecular Formula C18H23BrO4
Exact Mass 382.077972 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FbNizyTvzos
Name 1,2-Benzenediol, o-(6-bromohexanoyl)-o'-cyclopentanecarbonyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 382.077972217 u
Formula C18H23BrO4
InChI InChI=1S/C18H23BrO4/c19-13-7-1-2-12-17(20)22-15-10-5-6-11-16(15)23-18(21)14-8-3-4-9-14/h5-6,10-11,14H,1-4,7-9,12-13H2
InChIKey UNEDVXZCYZQCPT-UHFFFAOYSA-N
Molecular Weight 383.282 g/mol
SMILES C1(=CC=CC=C1OC(=O)CCCCCBr)OC(=O)C1CCCC1