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6H-Benzo[a]furo[3,2-h]xanthen-6-one, 1,2,11,12-tetrahydro-2-methyl-
SpectraBase Compound ID 2IU2VrhNQ4o
InChI InChI=1S/C20H16O3/c1-11-10-15-16(22-11)9-7-14-19(21)18-13-5-3-2-4-12(13)6-8-17(18)23-20(14)15/h2-5,7,9,11H,6,8,10H2,1H3
InChIKey DSNQTVKMPNEDAU-UHFFFAOYSA-N
Mol Weight 304.35 g/mol
Molecular Formula C20H16O3
Exact Mass 304.109944 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 26qUnHMcCcB
Name 6H-Benzo[A]furo[3,2-H]xanthen-6-one, 1,2,11,12-tetrahydro-2-methyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 304.109944372 u
Formula C20H16O3
InChI InChI=1S/C20H16O3/c1-11-10-15-16(22-11)9-7-14-19(21)18-13-5-3-2-4-12(13)6-8-17(18)23-20(14)15/h2-5,7,9,11H,6,8,10H2,1H3
InChIKey DSNQTVKMPNEDAU-UHFFFAOYSA-N
SMILES C1=2C(C=3C=CC4=C(C3OC2CCC=2C1=CC=CC2)CC(C)O4)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.871566