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9,10-Ethenoanthracene, 11-chloro-9,10-dihydro-2,3,6,7-tetramethyl-

View entire compound with spectra: 1 FTIR

9,10-Ethenoanthracene, 11-chloro-9,10-dihydro-2,3,6,7-tetramethyl-
SpectraBase Compound ID EXpV1zwkeCv
InChI InChI=1S/C20H19Cl/c1-10-5-14-16-9-19(21)20(17(14)7-12(10)3)18-8-13(4)11(2)6-15(16)18/h5-9,16,20H,1-4H3/t16-,20+
InChIKey VJRQXHBXTWKEIG-MOBUCQHHSA-N
Mol Weight 294.82 g/mol
Molecular Formula C20H19Cl
Exact Mass 294.117528 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3XDz3rgbhhj
Name 9,10-Ethenoanthracene, 11-chloro-9,10-dihydro-2,3,6,7-tetramethyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 294.117528312 u
Formula C20H19Cl
InChI InChI=1S/C20H19Cl/c1-10-5-14-16-9-19(21)20(17(14)7-12(10)3)18-8-13(4)11(2)6-15(16)18/h5-9,16,20H,1-4H3/t16-,20+
InChIKey VJRQXHBXTWKEIG-MOBUCQHHSA-N
SMILES [C@]12(C=3C(=CC(=C(C3)C)C)[C@@](C(=C1)Cl)(C1=C2C=C(C(C)=C1)C)[H])[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.820533