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(epi)gallocatechin
SpectraBase Compound ID 3XM9E7XsBqK
InChI InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12-,15-/m1/s1
InChIKey XMOCLSLCDHWDHP-IUODEOHRSA-N
Mol Weight 306.27 g/mol
Molecular Formula C15H14O7
Exact Mass 306.073953 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9uQSSsUUwij
Name (epi)gallocatechin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 306.073952784 u
Formula C15H14O7
InChI InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12-,15-/m1/s1
InChIKey XMOCLSLCDHWDHP-IUODEOHRSA-N
Instrument Name Xevo G2-S QToF
Ionization Type EI
Literature Reference DOI 10.1002/pca.3259
Quality 212
SMILES OC=1C=C(C=2C[C@]([C@@](C3=CC(=C(C(=C3)O)O)O)(OC2C1)[H])(O)[H])O
SPLASH splash10-000i-0900000000-b4df78b5b810895c9bc2
Source of Spectrum PA-34-SM23-(epi)gallocatechin (DOI: 10.1002/pca.3259)
Wiley ID 1911770