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

*Links on SpectraBase are not permalinks.
Fallacinol
SpectraBase Compound ID Aa9Aoij1bYi
InChI InChI=1S/C16H12O6/c1-22-8-4-10-14(12(19)5-8)16(21)13-9(15(10)20)2-7(6-17)3-11(13)18/h2-5,17-19H,6H2,1H3
InChIKey WJXSYUJKJSOJOG-UHFFFAOYSA-N
Mol Weight 300.27 g/mol
Molecular Formula C16H12O6
Exact Mass 300.063388 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 EI1wXwCmUgj
Name Fallacinol
Appearance Orange needles
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 300.063388100 u
Formula C16H12O6
InChI InChI=1S/C16H12O6/c1-22-8-4-10-14(12(19)5-8)16(21)13-9(15(10)20)2-7(6-17)3-11(13)18/h2-5,17-19H,6H2,1H3
InChIKey WJXSYUJKJSOJOG-UHFFFAOYSA-N
Instrument Name VG Micromass 7070F and JEOL JMS-AX505HF
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0002.712
Molecular Weight 300.266 g/mol
Quality 231
SMILES OCC1=CC=2C(C=3C=C(C=C(C3C(C2C(=C1)O)=O)O)OC)=O
SPLASH splash10-0zfr-6139000000-8b3d7d3b6a3517c4c3f5
Source of Spectrum ARK-2001-153-7 (DOI: 10.3998/ark.5550190.0002.712)
Thin-Layer Chromatography 0.25
Wiley ID 1908847