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trans-3,3',4',5,7-Flavanpentol hydrate

View entire compound with spectra: 2 NMR, 2 FTIR, and 1 Raman

trans-3,3',4',5,7-Flavanpentol hydrate
SpectraBase Compound ID EmQukfNLbR2
InChI InChI=1S/C15H14O6.H2O/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7;/h1-5,13,15-20H,6H2;1H2/t13-,15+;/s2
InChIKey OFUMQWOJBVNKLR-BYSCGGDUSA-N
Mol Weight 308.286 g/mol
Molecular Formula C15H16O7
Exact Mass 308.089603 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID 29HxZic0WOp
Name trans-3,3',4',5,7-Flavanpentol hydrate
Source of Sample Enzo Life Sciences
Catalog Number 385-017-G001
Lot Number L27810
CAS Registry Number 88191-48-4
Compound Type Pure
Copyright Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16O7
InChI InChI=1S/C15H14O6.H2O/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7;/h1-5,13,15-20H,6H2;1H2/t13-,15+;/s2
InChIKey OFUMQWOJBVNKLR-BYSCGGDUSA-N
Instrument Name Bio-Rad FTS
Source of Spectrum Forensic Spectral Research
Synonyms (+)-Catechin hydrate
Technique ATR-Neat (DuraSamplIR II)