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object
{15}
_id
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3zKQfqFHOll
spectrumID
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3zKQfqFHOll
cost
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specType
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131072
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WMSL3X:199386:1
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analyticalTechnique
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MS (GC)
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Mass Spectrum (GC)
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compound
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6,11[1',2']-Benzeno-5,12-epoxynaphthacene, 2,3-dibromo-5,5a,6,11,11a,12-hexahydro-
SpectraBase Compound ID 62wST1AqdxO
InChI InChI=1S/C24H16Br2O/c25-17-9-15-16(10-18(17)26)24-22-20-12-6-2-1-5-11(12)19(21(22)23(15)27-24)13-7-3-4-8-14(13)20/h1-10,19-24H/t19-,20+,21?,22?,23?,24?
InChIKey NMTADBHECJTOGJ-UHFFFAOYSA-N
Mol Weight 480.2 g/mol
Molecular Formula C24H16Br2O
Exact Mass 477.956791 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3zKQfqFHOll
Name 6,11[1',2']-Benzeno-5,12-epoxynaphthacene, 2,3-dibromo-5,5a,6,11,11a,12-hexahydro-
CAS Registry Number 106750-90-7
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H16Br2O
InChI InChI=1S/C24H16Br2O/c25-17-9-15-16(10-18(17)26)24-22-20-12-6-2-1-5-11(12)19(21(22)23(15)27-24)13-7-3-4-8-14(13)20/h1-10,19-24H/t19-,20+,21?,22?,23?,24?
InChIKey NMTADBHECJTOGJ-UHFFFAOYSA-N
Molecular Weight 480.199 g/mol
SMILES C12C3C([C@]4(c5c([C@@]3(c3c4cccc3)[H])cccc5)[H])C(O2)c2c1cc(c(Br)c2)Br
SPLASH splash10-002f-0920000000-a417eb5104ffb2ffaf76
Source of Spectrum F-42-1652-44
Synonyms 5,12-[1',2']benzo-5,12,6,11,5a,11a-hexahydro-6,11-epoxy-8,9-dibromo-tetracene 6,7-Dibromo-25-oxaheptacyclo[10.6.6.1(3,10).0(2,11).0(4,9).0(13,18).0(19,24)]pentacosa-4,6,8,13,15,17,19,21,23-nonaene
Wiley ID 1394686
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