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4,7-Methano-1H-indene-2,3-dicarboxylic acid, 3a,4,5,6,7,7a-hexahydro-1-oxo-, dimethyl ester, (3a.alpha.,4.beta.,7.beta.,7a.alpha.)-
SpectraBase Compound ID HUDHqp4ru1l
InChI InChI=1S/C14H16O5/c1-18-13(16)10-8-6-3-4-7(5-6)9(8)12(15)11(10)14(17)19-2/h6-9H,3-5H2,1-2H3/t6-,7+,8+,9-/m1/s1
InChIKey NBEQEUBBWAONCL-RYPBNFRJSA-N
Mol Weight 264.28 g/mol
Molecular Formula C14H16O5
Exact Mass 264.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BcQKGTj6yvX
Name 4,7-Methano-1H-indene-2,3-dicarboxylic acid, 3a,4,5,6,7,7a-hexahydro-1-oxo-, dimethyl ester, (3a.alpha.,4.beta.,7.beta.,7a.alpha.)-
Alternate Name(s) Dimethyl (1R,2S,6R,7S)-5-oxotricyclo[5.2.1.0(2,6)]dec-3-ene-3,4-dicarboxylate exo-2,3-bismethoxycarbonyl-4,7-methano-3a,4,5,6,7,7a-hexahydro-inden-1-one
CAS Registry Number 65055-65-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O5
InChI InChI=1S/C14H16O5/c1-18-13(16)10-8-6-3-4-7(5-6)9(8)12(15)11(10)14(17)19-2/h6-9H,3-5H2,1-2H3/t6-,7+,8+,9-/m1/s1
InChIKey NBEQEUBBWAONCL-RYPBNFRJSA-N
Molecular Weight 264.277 g/mol
SMILES C1(=C([C@]2([C@@]3(CC[C@]([C@]2(C1=O)[H])(C3)[H])[H])[H])C(=O)OC)C(=O)OC
SPLASH splash10-0i0r-0390000000-ecb43b4e4051088b73f7
Source of Spectrum H-60-2169-0
Wiley ID 1267769