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(S)-6,6'-di(pyren-1-yl)-2,2',3,3'-tetrahydro-1,1'-spirobi[indene]-7,7'-diol
SpectraBase Compound ID 2KWj97pcUC1
InChI InChI=1S/C49H32O2/c50-47-39(35-17-11-31-9-7-27-3-1-5-29-13-19-37(35)43(31)41(27)29)21-15-33-23-25-49(45(33)47)26-24-34-16-22-40(48(51)46(34)49)36-18-12-32-10-8-28-4-2-6-30-14-20-38(36)44(32)42(28)30/h1-22,50-51H,23-26H2/t49-/m0/s1
InChIKey LAMZPRFBLNVQNW-GGCSAXROSA-N
Mol Weight 652.8 g/mol
Molecular Formula C49H32O2
Exact Mass 652.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GsQRyEwLeTW
Name (S)-6,6'-di(pyren-1-yl)-2,2',3,3'-tetrahydro-1,1'-spirobi[indene]-7,7'-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C49H32O2
InChI InChI=1S/C49H32O2/c50-47-39(35-17-11-31-9-7-27-3-1-5-29-13-19-37(35)43(31)41(27)29)21-15-33-23-25-49(45(33)47)26-24-34-16-22-40(48(51)46(34)49)36-18-12-32-10-8-28-4-2-6-30-14-20-38(36)44(32)42(28)30/h1-22,50-51H,23-26H2/t49-/m0/s1
InChIKey LAMZPRFBLNVQNW-GGCSAXROSA-N
Molecular Weight 652.793 g/mol
SMILES Oc1c(ccc2c1[C@]1(CCc3c1c(c(cc3)-c1c3ccc4cccc5ccc(cc1)c3c45)O)CC2)-c1c2c3c(ccc4c3c(ccc4)cc2)cc1
SPLASH splash10-0udi-0002009000-79160228e60b905fc54e
Source of Spectrum ACI-53-SMS22-(S)_17
Wiley ID 1782300