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2,3,6,7,10,11-Hexaiodo-12d-methyldibenzo[2,3:4,5]pentaleno[1,6-ab]indene-4b,8b,12b(12dH)-triol
SpectraBase Compound ID LdM4eEYOBFS
InChI InChI=1S/C23H12I6O3/c1-20-21(30)8-2-14(24)15(25)3-9(8)22(20,31)12-6-18(28)19(29)7-13(12)23(20,32)11-5-17(27)16(26)4-10(11)21/h2-7,30-32H,1H3
InChIKey VHHDWROKCADYNZ-UHFFFAOYSA-N
Mol Weight 1097.77 g/mol
Molecular Formula C23H12I6O3
Exact Mass 1097.505464 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GUIfNZhOlU2
Name 2,3,6,7,10,11-Hexaiodo-12d-methyldibenzo[2,3:4,5]pentaleno[1,6-ab]indene-4b,8b,12b(12dH)-triol
Alternate Name(s) 4,5,11,12,18,19-hexaiodo-22-methylhexacyclo[13.6.1.0(2,7).0(8,22).0(9,14).0(16,21)]docosa-2(7),3,5,9(14),10,12,16(21),17,19-nonaene-1,8,15-triol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H12I6O3
InChI InChI=1S/C23H12I6O3/c1-20-21(30)8-2-14(24)15(25)3-9(8)22(20,31)12-6-18(28)19(29)7-13(12)23(20,32)11-5-17(27)16(26)4-10(11)21/h2-7,30-32H,1H3
InChIKey VHHDWROKCADYNZ-UHFFFAOYSA-N
Molecular Weight 1097.773 g/mol
SMILES OC12c3cc(c(cc3C3(C1(C(c1cc(c(cc31)I)I)(c1cc(c(cc21)I)I)O)C)O)I)I
SPLASH splash10-004i-3900000000-562c787fffc6d23e2fff
Source of Spectrum KC-57-3612-72
Wiley ID 1623886