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7-Benzyloxy-2',3'-dihydro-2',2'-dimethyl-o,6'-bi(4h-1-benzopyran)-4-one
SpectraBase Compound ID AGtDgXPIPNR
InChI InChI=1S/C27H24O4/c1-27(2)13-12-19-8-9-20(14-24(19)31-27)23-17-30-25-15-21(10-11-22(25)26(23)28)29-16-18-6-4-3-5-7-18/h3-11,14-15,17H,12-13,16H2,1-2H3
InChIKey NVODLKVRPZHUMH-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 FxpeyJCdMey
Name 7-Benzyloxy-2',3'-dihydro-2',2'-dimethyl-o,6'-bi(4h-1-benzopyran)-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H24O4
InChI InChI=1S/C27H24O4/c1-27(2)13-12-19-8-9-20(14-24(19)31-27)23-17-30-25-15-21(10-11-22(25)26(23)28)29-16-18-6-4-3-5-7-18/h3-11,14-15,17H,12-13,16H2,1-2H3
InChIKey NVODLKVRPZHUMH-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 412.485 g/mol
SMILES c1c2c(cc(c1)OCc1ccccc1)OC=C(c1ccc3c(c1)OC(CC3)(C)C)C2=O
SPLASH splash10-01ox-9112400000-f0e97465b14f9d7a0097
Source of Spectrum SRH-2022-1122-0
Synonyms 7-Benzyloxyisoneobavaisoflavone
Wiley ID 1823592