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ZLVHCWPTRLJYOL-UHFFFAOYSA-N
SpectraBase Compound ID HRqjxSeEYeh
InChI InChI=1S/C18H16O5/c1-4-18(2,3)10-8-12(20)17-13(15(10)22)14(21)9-6-5-7-11(19)16(9)23-17/h4-8,19-20,22H,1H2,2-3H3
InChIKey ZLVHCWPTRLJYOL-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 APQAWuPzn70
Name 1,4,5-trihydroxy-2-(2-methylbut-3-en-2-yl)-9-xanthenone
CAS Registry Number 124676-46-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16O5
InChI InChI=1S/C18H16O5/c1-4-18(2,3)10-8-12(20)17-13(15(10)22)14(21)9-6-5-7-11(19)16(9)23-17/h4-8,19-20,22H,1H2,2-3H3
InChIKey ZLVHCWPTRLJYOL-UHFFFAOYSA-N
Molecular Weight 312.321 g/mol
SMILES Oc1c2Oc3c(cccc3C(c2c(c(c1)C(C=C)(C)C)O)=O)O
SPLASH splash10-0002-0090000000-56ec9c2c971cb0bc527c
Source of Spectrum H1-40-283-3
Synonyms 9H-Xanthen-9-one, 2-(1,1-dimethyl-2-propenyl)-1,4,5-trihydroxy- 1,4,5-trihydroxy-2-(2-methylbut-3-en-2-yl)xanthen-9-one 2-(1,1-dimethyl-2-propenyl)-1,4,5-trihydroxy-9H-xanthen-9-one 2-(1,1-dimethylallyl)-1,4,5-trihydroxy-xanthen-9-one 2-(1,1-dimethylallyl)-1,4,5-trihydroxy-xanthone 2-(2-Methylbut-3-en-2-yl)-1,4,5-tris(oxidanyl)xanthen-9-one
Wiley ID 756942