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Dimethyl (1.alpha.,1a.beta.,1b.beta.,1c.beta.,3a.beta.,4.alpha.,6a.beta.,6b.beta.)-1,1a,1b,1c,3a,4,6a,6b-octahydro-1,4-ethenocyclobuta[c]cyclopropa[3,4]cyclobuta[1,2-a]cycloheptene-5,7-dicarboxylate
SpectraBase Compound ID 8W0jGF2dunM
InChI InChI=1S/C18H18O4/c1-21-17(19)10-6-11-13-8-4-3-7(8)9(10)5-12(18(20)22-2)15-14(11)16(13)15/h3-9,11,13-16H,1-2H3/b12-5+/t7-,8+,9-,11-,13+,14+,15-,16+/m1/s1
InChIKey ADKYSOCGHYVWPQ-MIXPAVJMSA-N
Mol Weight 298.34 g/mol
Molecular Formula C18H18O4
Exact Mass 298.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 61EdMxnjIot
Name Dimethyl (1.alpha.,1a.beta.,1b.beta.,1c.beta.,3a.beta.,4.alpha.,6a.beta.,6b.beta.)-1,1a,1b,1c,3a,4,6a,6b-octahydro-1,4-ethenocyclobuta[c]cyclopropa[3,4]cyclobuta[1,2-a]cycloheptene-5,7-dicarboxylate
CAS Registry Number 113627-84-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O4
InChI InChI=1S/C18H18O4/c1-21-17(19)10-6-11-13-8-4-3-7(8)9(10)5-12(18(20)22-2)15-14(11)16(13)15/h3-9,11,13-16H,1-2H3/b12-5+/t7-,8+,9-,11-,13+,14+,15-,16+/m1/s1
InChIKey ADKYSOCGHYVWPQ-MIXPAVJMSA-N
Molecular Weight 298.338 g/mol
SMILES [C@]12([C@@]3([C@@]4(C=C([C@](\C=C/2C(=O)OC)([C@@]2(C=C[C@@]2([C@@]4([C@]13[H])[H])[H])[H])[H])C(=O)OC)[H])[H])[H]
SPLASH splash10-004i-2910000000-35add11465a6e3d1a66e
Source of Spectrum C-110-3270-20
Synonyms Dimethyl (1R,2R,3S,4S,7R,8R,11R,12S)-pentacyclo[5.5.2.0(2,4).0(3,12).0(8,11)]tetradeca-5,9,13-triene-5,14-dicarboxylate
Wiley ID 1301093