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9,10-Etheno-4a,9a-methanoanthracene, 9,10-dihydro-, (4a.alpha.,9.alpha.,9a.alpha.,10.alpha.)-
SpectraBase Compound ID UB5qvohBpx
InChI InChI=1S/C17H14/c1-2-6-13-12(5-1)14-7-8-15(13)17-10-4-3-9-16(14,17)11-17/h1-10,14-15H,11H2
InChIKey DCJFWCNUJMFKFN-UHFFFAOYSA-N
Mol Weight 218.3 g/mol
Molecular Formula C17H14
Exact Mass 218.10955 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FzSa2pPekvp
Name 9,10-Etheno-4A,9A-methanoanthracene, 9,10-dihydro-, (4A.alpha.,9.alpha.,9A.alpha.,10.alpha.)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 218.109550451 u
Formula C17H14
InChI InChI=1S/C17H14/c1-2-6-13-12(5-1)14-7-8-15(13)17-10-4-3-9-16(14,17)11-17/h1-10,14-15H,11H2
InChIKey DCJFWCNUJMFKFN-UHFFFAOYSA-N
Molecular Weight 218.299 g/mol
SMILES C123C(C4C=CC3C3=C4C=CC=C3)(C=CC=C2)C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.800595