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1H-Indene-5,6-dicarboxylic acid, 2,3,4,5,6,7-hexahydro-1-oxo-, dimethyl ester, trans-
SpectraBase Compound ID JFVC2EBgsyf
InChI InChI=1S/C13H16O5/c1-17-12(15)9-5-7-3-4-11(14)8(7)6-10(9)13(16)18-2/h9-10H,3-6H2,1-2H3/t9-,10-/m0/s1
InChIKey RPLFDITWLLPMSI-UWVGGRQHSA-N
Mol Weight 252.27 g/mol
Molecular Formula C13H16O5
Exact Mass 252.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6lWTY9Momml
Name 1H-Indene-5,6-dicarboxylic acid, 2,3,4,5,6,7-hexahydro-1-oxo-, dimethyl ester, trans-
Alternate Name(s) Dimethyl (5S,6S)-1-oxo-2,3,4,5,6,7-hexahydro-1H-indene-5,6-dicarboxylate trans-3,4-di(methoxycarbonyl)-bicyclo[4.3.0]nona-1(6)-en-7-one
CAS Registry Number 112091-62-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O5
InChI InChI=1S/C13H16O5/c1-17-12(15)9-5-7-3-4-11(14)8(7)6-10(9)13(16)18-2/h9-10H,3-6H2,1-2H3/t9-,10-/m0/s1
InChIKey RPLFDITWLLPMSI-UWVGGRQHSA-N
Molecular Weight 252.266 g/mol
SMILES C12=C(C[C@@]([C@](C2)(C(=O)OC)[H])(C(=O)OC)[H])CCC1=O
SPLASH splash10-0536-2910000000-a839b89da805f2b017da
Source of Spectrum AJ-60-332-14
Wiley ID 1255373