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9,10[1',2']-Benzenoanthracene, 1,8-dichloro-9,10-dihydro-13-methyl-
SpectraBase Compound ID 6lL0REsjYrg
InChI InChI=1S/C21H14Cl2/c1-11-5-2-6-12-17(11)21-19-13(7-3-9-15(19)22)18(12)14-8-4-10-16(23)20(14)21/h2-10,18,21H,1H3/t18-,21+
InChIKey MELGARWRZNYZAX-RVWIWJKTSA-N
Mol Weight 337.25 g/mol
Molecular Formula C21H14Cl2
Exact Mass 336.047256 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID vcSqOn58Oy
Name 9,10[1',2']-Benzenoanthracene, 1,8-dichloro-9,10-dihydro-13-methyl-
Alternate Name(s) 1,8-Dichloro-13-methyltriptycene 3,13-dichloro-16-methylpentacyclo[6.6.6.0(2,7).0(9,14).0(15,20)]icosa-2,4,6,9,11,13,15,17,19-nonaene
CAS Registry Number 103259-07-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H14Cl2
InChI InChI=1S/C21H14Cl2/c1-11-5-2-6-12-17(11)21-19-13(7-3-9-15(19)22)18(12)14-8-4-10-16(23)20(14)21/h2-10,18,21H,1H3/t18-,21+
InChIKey MELGARWRZNYZAX-RVWIWJKTSA-N
Molecular Weight 337.249 g/mol
SMILES [C@]12(c3c(cccc3Cl)[C@@](c3c1c(ccc3)C)(c1c2c(Cl)ccc1)[H])[H]
SPLASH splash10-0fri-0369000000-7f9af578b7272ca4502e
Source of Spectrum J-51-3312-9
Wiley ID 1332595