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

*Links on SpectraBase are not permalinks.
Kirschsteinin
SpectraBase Compound ID GjkChKThAR4
InChI InChI=1S/C26H20O11/c1-8(16-14(36-3)6-11-19(23(16)32)13(29)7-15(37-4)21(11)30)17-24(33)20-10(22(31)26(17)35)5-12(28)18(9(2)27)25(20)34/h5-8,28,32,34-35H,1-4H3
InChIKey BBMLPMPNKPPBCD-UHFFFAOYSA-N
Mol Weight 508.44 g/mol
Molecular Formula C26H20O11
Exact Mass 508.100561 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 JHLMTwMsQir
Name Kirschsteinin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H20O11
InChI InChI=1S/C26H20O11/c1-8(16-14(36-3)6-11-19(23(16)32)13(29)7-15(37-4)21(11)30)17-24(33)20-10(22(31)26(17)35)5-12(28)18(9(2)27)25(20)34/h5-8,28,32,34-35H,1-4H3
InChIKey BBMLPMPNKPPBCD-UHFFFAOYSA-N
Molecular Weight 508.435 g/mol
SMILES Oc1c(c(c2c(C(C(=C(C(c3c(cc4C(C(=CC(c4c3O)=O)OC)=O)OC)C)C2=O)O)=O)c1)O)C(=O)C
SPLASH splash10-001i-0390010000-938bd0dcdf0519156d82
Source of Spectrum X2-55-1098-5
Wiley ID 1604550