Spiro{ 2H-dibenzo[f,h]-3,4-dihydro-1,5-dioxacyclononene[3,2' -1'H-2',3']-dihydrophenalene}

SpectraBase Compound ID	Gfx8S4aLvwz
InChI	InChI=1S/C27H22O2/c1-3-13-24-22(11-1)23-12-2-4-14-25(23)29-18-27(17-28-24)15-20-9-5-7-19-8-6-10-21(16-27)26(19)20/h1-14H,15-18H2
InChIKey	KAGVGHQUWMUGDK-UHFFFAOYSA-N Google Search
Mol Weight	378.47 g/mol
Molecular Formula	C27H22O2
Exact Mass	378.16198 g/mol

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SpectraBase Spectrum ID	Gc1w5osooHb
Name	Spiro{ 2H-dibenzo[F,H]-3,4-dihydro-1,5-dioxacyclononene[3,2' -1'H-2',3']-dihydrophenalene}
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	378.161979946 u
Formula	C27H22O2
InChI	InChI=1S/C27H22O2/c1-3-13-24-22(11-1)23-12-2-4-14-25(23)29-18-27(17-28-24)15-20-9-5-7-19-8-6-10-21(16-27)26(19)20/h1-14H,15-18H2
InChIKey	KAGVGHQUWMUGDK-UHFFFAOYSA-N
Molecular Weight	378.471 g/mol
SMILES	C12=C3C(=CC=CC3=CC=C1)CC1(C2)COC2=C(C=CC=C2)C2=C(OC1)C=CC=C2
Spectrum/Structure Validation Score (Vapor Phase IR)	0.95703