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exo-[4-(p-Methoxyphenyl)-3,6-methoxy-9,10-dihydrophenanthreno)-2':3',9:10-norbornane
SpectraBase Compound ID C1mNUxkRRcV
InChI InChI=1S/C28H28O3/c1-29-19-8-6-16(7-9-19)27-24(31-3)13-12-22-26-18-5-4-17(14-18)25(26)21-11-10-20(30-2)15-23(21)28(22)27/h6-13,15,17-18,25-26H,4-5,14H2,1-3H3/t17-,18+,25-,26+/m1/s1
InChIKey XTTPQBJKKBFOEC-LSCRHLIXSA-N
Mol Weight 412.53 g/mol
Molecular Formula C28H28O3
Exact Mass 412.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7IjCq2shQqD
Name exo-[4-(p-Methoxyphenyl)-3,6-methoxy-9,10-dihydrophenanthreno)-2':3',9:10-norbornane
Alternate Name(s) 6,11-dimethoxy-7-(4-methoxyphenyl)pentacyclo[14.2.1.0(2,15).0(3,8).0(9,14)]nonadeca-3,5,7,9,11,13-hexaene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H28O3
InChI InChI=1S/C28H28O3/c1-29-19-8-6-16(7-9-19)27-24(31-3)13-12-22-26-18-5-4-17(14-18)25(26)21-11-10-20(30-2)15-23(21)28(22)27/h6-13,15,17-18,25-26H,4-5,14H2,1-3H3/t17-,18+,25-,26+/m1/s1
InChIKey XTTPQBJKKBFOEC-LSCRHLIXSA-N
Molecular Weight 412.529 g/mol
SMILES c1-2c([C@@]3([C@@]4(C[C@]([C@@]3(c3c2cc(cc3)OC)[H])(CC4)[H])[H])[H])ccc(c1-c1ccc(cc1)OC)OC
SPLASH splash10-03di-0012900000-76e937a65cdedb261f3a
Source of Spectrum F-50-391-4
Wiley ID 1374681