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3,6-Dihydroxy-7,8-dimethyl-2-(2-propenyl)phenanthrene-1,4-dione
SpectraBase Compound ID L6nFgtr0m22
InChI InChI=1S/C19H16O4/c1-4-5-13-17(21)12-7-6-11-9(2)10(3)15(20)8-14(11)16(12)19(23)18(13)22/h4,6-8,20,22H,1,5H2,2-3H3
InChIKey YHBZFGCUTYFTFK-UHFFFAOYSA-N
Mol Weight 308.33 g/mol
Molecular Formula C19H16O4
Exact Mass 308.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C1L1RWb7z01
Name 3,6-Dihydroxy-7,8-dimethyl-2-(2-propenyl)phenanthrene-1,4-dione
CAS Registry Number 106805-38-3
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16O4
InChI InChI=1S/C19H16O4/c1-4-5-13-17(21)12-7-6-11-9(2)10(3)15(20)8-14(11)16(12)19(23)18(13)22/h4,6-8,20,22H,1,5H2,2-3H3
InChIKey YHBZFGCUTYFTFK-UHFFFAOYSA-N
Molecular Weight 308.333 g/mol
SMILES Oc1c(c(c2c(c3C(C(=C(C(c3cc2)=O)CC=C)O)=O)c1)C)C
SPLASH splash10-0a4i-0396000000-58ed9f69263b8def733f
Source of Spectrum H-69-1413-6
Synonyms 2-Allyl-3,6-dihydroxy-7,8-dimethyl-1,4-phenanthrenedione
Wiley ID 1309996