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5-{1,1'-Biphenyl-4-(carbonyloxy)-4-[(butyryloxy)methyl]-hexahydro-2H-cyclopenta[b]furan-2-one
SpectraBase Compound ID H62XmUAxJdg
InChI InChI=1S/C25H26O6/c1-2-6-23(27)29-15-21-20-13-24(28)31-22(20)14-25(21,30-16-26)19-11-9-18(10-12-19)17-7-4-3-5-8-17/h3-5,7-12,16,20-22H,2,6,13-15H2,1H3/t20-,21-,22+,25+/m0/s1
InChIKey RFJOXONVCSAWDU-VRIJDZSUSA-N
Mol Weight 422.48 g/mol
Molecular Formula C25H26O6
Exact Mass 422.172939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ANxRXy2Ysbg
Name 5-{1,1'-Biphenyl-4-(carbonyloxy)-4-[(butyryloxy)methyl]-hexahydro-2H-cyclopenta[b]furan-2-one
Alternate Name(s) 5-(1,1'-Biphenyl-4-ly)-5-(carbonyloxy)-4-[(butyryloxy)methyl]-hexahydro-2H-cyclopenta[b]furan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H26O6
InChI InChI=1S/C25H26O6/c1-2-6-23(27)29-15-21-20-13-24(28)31-22(20)14-25(21,30-16-26)19-11-9-18(10-12-19)17-7-4-3-5-8-17/h3-5,7-12,16,20-22H,2,6,13-15H2,1H3/t20-,21-,22+,25+/m0/s1
InChIKey RFJOXONVCSAWDU-VRIJDZSUSA-N
Molecular Weight 422.477 g/mol
SMILES [C@]1([C@]([C@@]2(CC(O[C@@]2(C1)[H])=O)[H])(COC(=O)CCC)[H])(c1ccc(cc1)-c1ccccc1)OC=O
SPLASH splash10-008a-0900300000-3dd8d52f0eede81fe5dc
Source of Spectrum G-57-360-0
Wiley ID 813296