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Dimethyl cis-bicyclo[3.3.0]octa-2,6-diene-1,5-dicarboxylate
SpectraBase Compound ID 4JAniAcOKLq
InChI InChI=1S/C12H14O4/c1-15-9(13)11-5-3-7-12(11,8-4-6-11)10(14)16-2/h3-5,8H,6-7H2,1-2H3/t11-,12+/m1/s1
InChIKey SDFLLXXXURWTAX-NEPJUHHUSA-N
Mol Weight 222.24 g/mol
Molecular Formula C12H14O4
Exact Mass 222.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ErcehLnTLlJ
Name Dimethyl cis-bicyclo[3.3.0]octa-2,6-diene-1,5-dicarboxylate
CAS Registry Number 111718-17-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O4
InChI InChI=1S/C12H14O4/c1-15-9(13)11-5-3-7-12(11,8-4-6-11)10(14)16-2/h3-5,8H,6-7H2,1-2H3/t11-,12+/m1/s1
InChIKey SDFLLXXXURWTAX-NEPJUHHUSA-N
Molecular Weight 222.240 g/mol
SMILES [C@]12([C@](C(=O)OC)(C=CC2)CC=C1)C(=O)OC
SPLASH splash10-0ik9-1900000000-7183ca0c0a6a6d931908
Source of Spectrum K-121-653-21
Synonyms Dimethyl (3aR,6aR)-3a,6a(1H,4H)-pentalenedicarboxylate
Wiley ID 1222272