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2,3,13,14-Tetrabromo-6,7,9,10,17,18,20,21-octahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecine

View entire compound with spectra: 2 MS (GC)

2,3,13,14-Tetrabromo-6,7,9,10,17,18,20,21-octahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecine
SpectraBase Compound ID B9m1ytwwl7R
InChI InChI=1S/C20H20Br4O6/c21-13-9-17-18(10-14(13)22)29-7-3-26-4-8-30-20-12-16(24)15(23)11-19(20)28-6-2-25-1-5-27-17/h9-12H,1-8H2
InChIKey ZFNKSTYKNGWSLK-UHFFFAOYSA-N
Mol Weight 675.99 g/mol
Molecular Formula C20H20Br4O6
Exact Mass 671.79934 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DZU8JQk5HJf
Name 2,3,13,14-Tetrabromo-6,7,9,10,17,18,20,21-octahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecine
CAS Registry Number 40100-11-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20Br4O6
InChI InChI=1S/C20H20Br4O6/c21-13-9-17-18(10-14(13)22)29-7-3-26-4-8-30-20-12-16(24)15(23)11-19(20)28-6-2-25-1-5-27-17/h9-12H,1-8H2
InChIKey ZFNKSTYKNGWSLK-UHFFFAOYSA-N
Molecular Weight 675.990 g/mol
SMILES c12c(cc(c(c2)Br)Br)OCCOCCOc2cc(c(cc2OCCOCCO1)Br)Br
SPLASH splash10-002f-0190001000-ef794d422e3c87cfdeab
Source of Spectrum NP-16-2081-0
Synonyms 5,6,5',6'-Tetrabromo-dibenzo-18-crown-6 20,21,24,25-Tetrabromo-2,3,11,12-dibenzo-1,4,7,10,13,16-hexaoxacyclooctadeca-2,11-diene 1,2-bis(n-butylthio)-4,5-dimethoxybenzene Decahydro-5,5',6,6'-tetrabromodibenzo-1,4,7,10,13,16-hexaoxacyclooctadecine
Wiley ID 1113278