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(trans)-2,5-Dimethoxy-3,4-dibromo-10-chlorobenzo[b]-(1,6,6a,12a-tetrahydro)xanthone

View entire compound with spectra: 1 MS (GC)

(trans)-2,5-Dimethoxy-3,4-dibromo-10-chlorobenzo[b]-(1,6,6a,12a-tetrahydro)xanthone
SpectraBase Compound ID 9j22cLUroz5
InChI InChI=1S/C19H15Br2ClO4/c1-24-18-9-6-12-14(7-10(9)19(25-2)16(21)15(18)20)26-13-4-3-8(22)5-11(13)17(12)23/h3-5,12,14H,6-7H2,1-2H3/t12-,14-/m1/s1
InChIKey AIFRRWIAGUPBIQ-TZMCWYRMSA-N
Mol Weight 502.59 g/mol
Molecular Formula C19H15Br2ClO4
Exact Mass 499.902563 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1iPh4GmHdcR
Name (trans)-2,5-Dimethoxy-3,4-dibromo-10-chlorobenzo[b]-(1,6,6a,12a-tetrahydro)xanthone
Alternate Name(s) (5aR,11aR)-8,9-bis(bromanyl)-2-chloranyl-7,10-dimethoxy-5a,6,11,11a-tetrahydrobenzo[b]xanthen-12-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H15Br2ClO4
InChI InChI=1S/C19H15Br2ClO4/c1-24-18-9-6-12-14(7-10(9)19(25-2)16(21)15(18)20)26-13-4-3-8(22)5-11(13)17(12)23/h3-5,12,14H,6-7H2,1-2H3/t12-,14-/m1/s1
InChIKey AIFRRWIAGUPBIQ-TZMCWYRMSA-N
Molecular Weight 502.586 g/mol
SMILES c12c(c(OC)c(c(c2OC)Br)Br)C[C@@]2([C@@](C1)(C(c1cc(Cl)ccc1O2)=O)[H])[H]
SPLASH splash10-0udi-0520890000-dd0dbfda74c96fa9fd88
Source of Spectrum AH-134-559-4
Wiley ID 1546832