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Dimethyl (2RS,2aSR,3SR,4SR,8bRS)-1,2,2a,3,4,8b-Hexahydro-2,4-methanocyclobuta[a]naphthalene-3,7-dicarboxylate
SpectraBase Compound ID 9Wk1Dd7NoOZ
InChI InChI=1S/C17H18O4/c1-20-16(18)8-3-4-10-11(5-8)13-7-9-6-12(10)15(14(9)13)17(19)21-2/h3-5,9,12-15H,6-7H2,1-2H3/t9-,12+,13-,14-,15?/m0/s1
InChIKey YYNXGLKQICDFNB-YLFIBZOBSA-N
Mol Weight 286.33 g/mol
Molecular Formula C17H18O4
Exact Mass 286.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 25lgj0M5dL0
Name Dimethyl (2RS,2aSR,3SR,4SR,8bRS)-1,2,2a,3,4,8b-Hexahydro-2,4-methanocyclobuta[a]naphthalene-3,7-dicarboxylate
Alternate Name(s) Dimethyl tetracyclo[8.2.1.0(2,7).0(8,11)]trideca-2,4,6-triene-5,12-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O4
InChI InChI=1S/C17H18O4/c1-20-16(18)8-3-4-10-11(5-8)13-7-9-6-12(10)15(14(9)13)17(19)21-2/h3-5,9,12-15H,6-7H2,1-2H3/t9-,12+,13-,14-,15?/m0/s1
InChIKey YYNXGLKQICDFNB-YLFIBZOBSA-N
Molecular Weight 286.327 g/mol
SMILES c12[C@]3([C@]4(C([C@@](c2ccc(c1)C(=O)OC)(C[C@]4(C3)[H])[H])C(=O)OC)[H])[H]
SPLASH splash10-0a4l-6920000000-32171383736418af7967
Source of Spectrum AJ-66-549-34
Wiley ID 771915