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9,10-Ethanoanthracene-11-carboxylic acid, 9,10-dihydro-12-(phenylsulfinyl)-, methyl ester, [11.alpha.,12.alpha.(R*)]-
SpectraBase Compound ID AUJFFqeMTEx
InChI InChI=1S/C24H20O3S/c1-27-24(25)22-20-16-11-5-7-13-18(16)21(19-14-8-6-12-17(19)20)23(22)28(26)15-9-3-2-4-10-15/h2-14,20-23H,1H3/t20-,21+,22-,23+,28?/m0/s1
InChIKey YSKPJBRRLHARSY-YLTUBHGCSA-N
Mol Weight 388.48 g/mol
Molecular Formula C24H20O3S
Exact Mass 388.113316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A3tOizjp3bY
Name 9,10-Ethanoanthracene-11-carboxylic acid, 9,10-dihydro-12-(phenylsulfinyl)-, methyl ester, [11.alpha.,12.alpha.(R*)]-
Alternate Name(s) Methyl (11R*,12R*)-12-phenylsulfinyl-9,10-dihydro-9,10-ethanoanthracene-11-carboxylate Methyl (15R,16R)-16-(phenylsulfinyl)tetracyclo[6.6.2.0(2,7).0(9,14)]hexadeca-2,4,6,9,11,13-hexaene-15-carboxylate
CAS Registry Number 106499-25-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H20O3S
InChI InChI=1S/C24H20O3S/c1-27-24(25)22-20-16-11-5-7-13-18(16)21(19-14-8-6-12-17(19)20)23(22)28(26)15-9-3-2-4-10-15/h2-14,20-23H,1H3/t20-,21+,22-,23+,28?/m0/s1
InChIKey YSKPJBRRLHARSY-YLTUBHGCSA-N
Molecular Weight 388.481 g/mol
SMILES [C@]1([C@]2(c3ccccc3[C@@]([C@]1([S@@](=O)c1ccccc1)[H])(c1ccccc21)[H])[H])(C(=O)OC)[H]
SPLASH splash10-03du-9060000000-b483a5f9b3e0967d3945
Source of Spectrum B-39-588-0
Wiley ID 1363992