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1,4,9,10-Tetrahydro-2-(5'-ethoxypentanoyl)-9,10-(o-benzeno)anthracene-1,4-dione
SpectraBase Compound ID 2BQXpSmj2pu
InChI InChI=1S/C27H24O4/c1-2-31-14-8-7-13-21(28)20-15-22(29)25-23-16-9-3-5-11-18(16)24(26(25)27(20)30)19-12-6-4-10-17(19)23/h3-6,9-12,15,23-24H,2,7-8,13-14H2,1H3
InChIKey YYKZHRYGELMOTM-UHFFFAOYSA-N
Mol Weight 412.49 g/mol
Molecular Formula C27H24O4
Exact Mass 412.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BgryUqWCu6k
Name 1,4,9,10-Tetrahydro-2-(5'-ethoxypentanoyl)-9,10-(o-benzeno)anthracene-1,4-dione
Alternate Name(s) 4-(5-Ethoxypentanoyl)pentacyclo[6.6.6.0(2,7).0(9,14).0(15,20)]icosa-2(7),4,9,11,13,15,17,19-octaene-3,6-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H24O4
InChI InChI=1S/C27H24O4/c1-2-31-14-8-7-13-21(28)20-15-22(29)25-23-16-9-3-5-11-18(16)24(26(25)27(20)30)19-12-6-4-10-17(19)23/h3-6,9-12,15,23-24H,2,7-8,13-14H2,1H3
InChIKey YYKZHRYGELMOTM-UHFFFAOYSA-N
Molecular Weight 412.485 g/mol
SMILES C12=C(C3c4c(C2c2c3cccc2)cccc4)C(=O)C=C(C1=O)C(=O)CCCCOCC
SPLASH splash10-0ik9-0064900000-279005912d2760fb4c48
Source of Spectrum U-1997-1958-18
Wiley ID 770200