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5,11[1',2']-Benzeno-5H-cyclohepta[b]naphthalene, 5-bromo-5a,11-dihydro-
SpectraBase Compound ID 9hU2Tbm75xz
InChI InChI=1S/C21H15Br/c22-21-17-11-3-1-2-8-14(17)20(15-9-4-6-12-18(15)21)16-10-5-7-13-19(16)21/h1-13,17,20H/t17?,20-,21-
InChIKey JGUUOYAMDIPGEE-XYGNKKJESA-N
Mol Weight 347.26 g/mol
Molecular Formula C21H15Br
Exact Mass 346.035713 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID s9yS1iE2iu
Name 5,11[1',2']-Benzeno-5H-cyclohepta[b]naphthalene, 5-bromo-5a,11-dihydro-
Alternate Name(s) 5-Bromo-5,10-O-cyclohepta-1',3',5'-trieno-5,10-dihydroanthracene 9-Bromopentacyclo[7.6.6.0(2,8).0(10,15).0(16,21)]henicosa-2,4,6,10,12,14,16,18,20-nonaene
CAS Registry Number 106053-11-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H15Br
InChI InChI=1S/C21H15Br/c22-21-17-11-3-1-2-8-14(17)20(15-9-4-6-12-18(15)21)16-10-5-7-13-19(16)21/h1-13,17,20H/t17?,20-,21-
InChIKey JGUUOYAMDIPGEE-XYGNKKJESA-N
Molecular Weight 347.255 g/mol
SMILES [C@]12(C3C(=CC=CC=C3)[C@@](c3c1cccc3)(c1c2cccc1)[H])Br
SPLASH splash10-05mk-0098000000-645bfba3c0466492f59f
Source of Spectrum AJ-59-1097-6
Wiley ID 1339425