4,8-Dihydroxy-7-(hydroxymethyl)-6-methoxy-3,4-dihydro-1(2H)-naphthalenone

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Systematic / IUPAC Name: 4,8-Dihydroxy-7-(hydroxymethyl)-6-methoxy-3,4-dihydro-1(2H)-naphthalenone

ID: Reference7649

Other Names: 1(2H)-Naphthalenone, 3,4-dihydro-4,8-dihydroxy-7-(hydroxymethyl)-6-methoxy-

Formula: C12H14O5

Spectral Data

4,8-Dihydroxy-7-(hydroxymethyl)-6-methoxy-3,4-dihydro-1(2H)-naphthalenone mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP FAIMS
No. of Spectral Trees 1
No. of Spectra 161
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 3/27/2018 11:43:05 AM
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Identificators

InChI InChI=1S/C12H14O5/c1-17-10-4-6-8(14)2-3-9(15)11(6)12(16)7(10)5-13/h4,8,13-14,16H,2-3,5H2,1H3
InChI Key NXSUIALRPVXVTA-UHFFFAOYSA-N
Canonical SMILES COC1=C(C(=C2C(=O)CCC(C2=C1)O)O)CO
CAS
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Other Names 1(2H)-Naphthalenone, 3,4-dihydro-4,8-dihydroxy-7-(hydroxymethyl)-6-methoxy-

In Other Databases

ChemSpider 8167356
PubChem 9991774