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Pancixanthone-A

View entire compound with spectra: 1 MS (GC)

Pancixanthone-A
SpectraBase Compound ID IBv7dlIVRMI
InChI InChI=1S/C18H16O5/c1-4-18(2,3)14-12(21)8-11(20)13-15(22)9-6-5-7-10(19)16(9)23-17(13)14/h4-8,19-21H,1H2,2-3H3
InChIKey PNPYKPQUXNWIPR-UHFFFAOYSA-N
Mol Weight 312.32 g/mol
Molecular Formula C18H16O5
Exact Mass 312.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 32SklbldRzv
Name Pancixanthone-A
Alternate Name(s) 1,3,5-trihydroxy-4-(2-methylbut-3-en-2-yl)-9-xanthenone 1,3,5-trihydroxy-4-(2-methylbut-3-en-2-yl)xanthen-9-one 4-(1,1-dimethylallyl)-1,3,5-trihydroxy-xanthen-9-one 4-(2-Methylbut-3-en-2-yl)-1,3,5-tris(oxidanyl)xanthen-9-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16O5
InChI InChI=1S/C18H16O5/c1-4-18(2,3)14-12(21)8-11(20)13-15(22)9-6-5-7-10(19)16(9)23-17(13)14/h4-8,19-21H,1H2,2-3H3
InChIKey PNPYKPQUXNWIPR-UHFFFAOYSA-N
Molecular Weight 312.321 g/mol
SMILES Oc1cccc2c1Oc1c(c(cc(c1C(C=C)(C)C)O)O)C2=O
SPLASH splash10-06r2-0093000000-079d13b606db23003272
Source of Spectrum E1-44-443-3
Wiley ID 1553347