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trans-3',5'-Di(9-phenanthryl)dispiro[1,3-dioxolane-2,1'-cyclohexan-4',2''-indane]-1'',3''-diol
SpectraBase Compound ID dcny99TABp
InChI InChI=1S/C44H36O4/c45-41-35-19-9-10-20-36(35)42(46)44(41)39(37-23-27-11-1-3-13-29(27)31-15-5-7-17-33(31)37)25-43(47-21-22-48-43)26-40(44)38-24-28-12-2-4-14-30(28)32-16-6-8-18-34(32)38/h1-20,23-24,39-42,45-46H,21-22,25-26H2/t39-,40-,41?,42?/m1/s1
InChIKey ROEBVBQSCPNZDZ-PPSFMLEKSA-N
Mol Weight 628.8 g/mol
Molecular Formula C44H36O4
Exact Mass 628.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2KtmE2j1qoi
Name trans-3',5'-Di(9-phenanthryl)dispiro[1,3-dioxolane-2,1'-cyclohexan-4',2''-indane]-1'',3''-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C44H36O4
InChI InChI=1S/C44H36O4/c45-41-35-19-9-10-20-36(35)42(46)44(41)39(37-23-27-11-1-3-13-29(27)31-15-5-7-17-33(31)37)25-43(47-21-22-48-43)26-40(44)38-24-28-12-2-4-14-30(28)32-16-6-8-18-34(32)38/h1-20,23-24,39-42,45-46H,21-22,25-26H2/t39-,40-,41?,42?/m1/s1
InChIKey ROEBVBQSCPNZDZ-PPSFMLEKSA-N
Molecular Weight 628.768 g/mol
SMILES OC1C2(C(c3ccccc13)O)[C@@](c1c3c(cccc3)c3c(c1)cccc3)(CC1(C[C@@]2(c2c3c(cccc3)c3c(c2)cccc3)[H])OCCO1)[H]
SPLASH splash10-0udi-1297000000-5481e962f1d200c24a2d
Source of Spectrum U1-2014-62-11
Wiley ID 1740576