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1,3,5-Tris(5'-tert-butoxycarbonylspiro[2.5]oct-7'-en-8'-yl)benzene

View entire compound with spectra: 1 MS (GC)

1,3,5-Tris(5'-tert-butoxycarbonylspiro[2.5]oct-7'-en-8'-yl)benzene
SpectraBase Compound ID 8Gb6Cy7kFYI
InChI InChI=1S/C45H60O6/c1-40(2,3)49-37(46)28-10-13-34(43(25-28)16-17-43)31-22-32(35-14-11-29(26-44(35)18-19-44)38(47)50-41(4,5)6)24-33(23-31)36-15-12-30(27-45(36)20-21-45)39(48)51-42(7,8)9/h13-15,22-24,28-30H,10-12,16-21,25-27H2,1-9H3
InChIKey SLXAZKOCISUERH-UHFFFAOYSA-N
Mol Weight 697.0 g/mol
Molecular Formula C45H60O6
Exact Mass 696.43899 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2uukDeJReS
Name 1,3,5-Tris(5'-tert-butoxycarbonylspiro[2.5]oct-7'-en-8'-yl)benzene
Alternate Name(s) tert-Butyl 8-{3,5-bis[7-(tert-butoxycarbonyl)spiro[2.5]oct-4-en-4-yl]phenyl}spiro[2.5]oct-7-ene-5-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C45H60O6
InChI InChI=1S/C45H60O6/c1-40(2,3)49-37(46)28-10-13-34(43(25-28)16-17-43)31-22-32(35-14-11-29(26-44(35)18-19-44)38(47)50-41(4,5)6)24-33(23-31)36-15-12-30(27-45(36)20-21-45)39(48)51-42(7,8)9/h13-15,22-24,28-30H,10-12,16-21,25-27H2,1-9H3
InChIKey SLXAZKOCISUERH-UHFFFAOYSA-N
Molecular Weight 696.969 g/mol
SMILES C12(C(c3cc(C=4C5(CC5)CC(C(OC(C)(C)C)=O)CC4)cc(C=4C5(CC5)CC(C(OC(C)(C)C)=O)CC4)c3)=CCC(C(OC(C)(C)C)=O)C1)CC2
SPLASH splash10-0a6r-9000184000-c3951e076031f0c84ff1
Source of Spectrum QE-8-2366-40
Wiley ID 1557738