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

*Links on SpectraBase are not permalinks.

K1115-A

View entire compound with spectra: 1 NMR, and 1 MS (GC)

K1115-A
SpectraBase Compound ID 7EcRgpYxX5B
InChI InChI=1S/C18H14O6/c1-2-4-8-13-10(7-12(20)15(8)18(23)24)16(21)9-5-3-6-11(19)14(9)17(13)22/h3,5-7,19-20H,2,4H2,1H3,(H,23,24)
InChIKey FNFBCXUSCQLQFP-UHFFFAOYSA-N
Mol Weight 326.3 g/mol
Molecular Formula C18H14O6
Exact Mass 326.079038 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 IwwavHufUOM
Name 3,8-bis(oxidanyl)-9,10-bis(oxidanylidene)-1-propyl-anthracene-2-carboxylic acid
Alternate Name(s) 3,8-Dihydroxy-9,10-diketo-1-propyl-anthracene-2-carboxylic acid 3,8-Dihydroxy-9,10-dioxo-1-propyl-2-anthracenecarboxylic acid 3,8-Dihydroxy-9,10-dioxo-1-propyl-anthracene-2-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14O6
InChI InChI=1S/C18H14O6/c1-2-4-8-13-10(7-12(20)15(8)18(23)24)16(21)9-5-3-6-11(19)14(9)17(13)22/h3,5-7,19-20H,2,4H2,1H3,(H,23,24)
InChIKey FNFBCXUSCQLQFP-UHFFFAOYSA-N
Molecular Weight 326.304 g/mol
SMILES Oc1cccc2C(c3c(c(c(c(c3)O)C(=O)O)CCC)C(c12)=O)=O
SPLASH splash10-0006-0093000000-9ef77be6029cb72056c8
Source of Spectrum K-2001-3197-8
Wiley ID 1580072