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1,4,9,10-Tetrahydro-1,4-dimethyl-9,10[1',2']benzeno-1,4-epoxyanthracene
SpectraBase Compound ID 7kJgvZO765E
InChI InChI=1S/C22H18O/c1-21-11-12-22(2,23-21)20-18-15-9-5-3-7-13(15)17(19(20)21)14-8-4-6-10-16(14)18/h3-12,17-18H,1-2H3/t17-,18+,21?,22?
InChIKey XFDTVLMDZOERQN-UHFFFAOYSA-N
Mol Weight 298.38 g/mol
Molecular Formula C22H18O
Exact Mass 298.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JAaw15vsU25
Name 1,4,9,10-Tetrahydro-1,4-dimethyl-9,10[1',2']benzeno-1,4-epoxyanthracene
CAS Registry Number 78837-41-9
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18O
InChI InChI=1S/C22H18O/c1-21-11-12-22(2,23-21)20-18-15-9-5-3-7-13(15)17(19(20)21)14-8-4-6-10-16(14)18/h3-12,17-18H,1-2H3/t17-,18+,21?,22?
InChIKey XFDTVLMDZOERQN-UHFFFAOYSA-N
Molecular Weight 298.385 g/mol
SMILES C12=C(C3(C)OC2(C=C3)C)[C@]2(c3c([C@@]1(c1c2cccc1)[H])cccc3)[H]
SPLASH splash10-055k-0090000000-2affe37c5581c416d14c
Source of Spectrum J-46-4432-0
Synonyms 3,6-Dimethyl-21-oxahexacyclo[6.6.6.1(3,6).0(2,7).0(9,14).0(15,20)]henicosa-2(7),4,9,11,13,15,17,19-octaene
Wiley ID 1301630