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

*Links on SpectraBase are not permalinks.
1,4-Dihydroxybenzo[2,3-b]dicyclo[2.3.2]nona-6,8-dien-5-one,-6-chloro
SpectraBase Compound ID IfcN4msDLV5
InChI InChI=1S/C13H9ClO3/c14-8-5-6-1-2-7(8)13(17)12-10(16)4-3-9(15)11(6)12/h1-7,15-16H/t6-,7-/m0/s1
InChIKey APDQXYQFCUICQP-BQBZGAKWSA-N
Mol Weight 248.66 g/mol
Molecular Formula C13H9ClO3
Exact Mass 248.024022 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 5JsMLXhCEnb
Name 1,4-Dihydroxybenzo[2,3-b]dicyclo[2.3.2]nona-6,8-dien-5-one,-6-chloro
Alternate Name(s) 10-chloro-3,6-dihydroxytricyclo[7.2.2.0(2,7)]trideca-2,4,6,10,12-pentaen-8-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H9ClO3
InChI InChI=1S/C13H9ClO3/c14-8-5-6-1-2-7(8)13(17)12-10(16)4-3-9(15)11(6)12/h1-7,15-16H/t6-,7-/m0/s1
InChIKey APDQXYQFCUICQP-BQBZGAKWSA-N
Molecular Weight 248.665 g/mol
SMILES Oc1c2[C@@]3(C=C([C@@](C(c2c(cc1)O)=O)(C=C3)[H])Cl)[H]
SPLASH splash10-01ot-0590000000-a07b02fefbdbce23fa1d
Source of Spectrum AJ-63-1638-9
Wiley ID 1250836