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4,4'-DIMETHOXYCARBONYL-2,2'-SPIROBI-S-HYDRINDACENE
SpectraBase Compound ID IcUxHV536p
InChI InChI=1S/C27H28O4/c1-30-25(28)23-19-7-3-5-15(19)9-17-11-27(13-21(17)23)12-18-10-16-6-4-8-20(16)24(22(18)14-27)26(29)31-2/h9-10H,3-8,11-14H2,1-2H3
InChIKey JDCKLAWDBNRXBJ-UHFFFAOYSA-N
Mol Weight 416.52 g/mol
Molecular Formula C27H28O4
Exact Mass 416.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7uwMPxhm5Sa
Name 6,6'-spirobi[2,3,5,7-tetrahydro-1H-s-indacene]-4,4'-dicarboxylic acid dimethyl ester
CAS Registry Number 117460-52-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H28O4
InChI InChI=1S/C27H28O4/c1-30-25(28)23-19-7-3-5-15(19)9-17-11-27(13-21(17)23)12-18-10-16-6-4-8-20(16)24(22(18)14-27)26(29)31-2/h9-10H,3-8,11-14H2,1-2H3
InChIKey JDCKLAWDBNRXBJ-UHFFFAOYSA-N
Molecular Weight 416.517 g/mol
SMILES c12c(c3CCCc3cc2CC2(C1)Cc1c(c3CCCc3cc1C2)C(=O)OC)C(=O)OC
SPLASH splash10-001i-0009000000-4bd83137fbef18e13f21
Source of Spectrum AH-119-643-30
Synonyms Dimethyl 6,6'-spirobi[2,3,5,7-tetrahydro-1H-s-indacene]-4,4'-dicarboxylate
Wiley ID 1376562