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4,4'-bis(3-Hydroxy-7,12-dioxaspiro[5.6]dodecan-3-yl] biphenyl
SpectraBase Compound ID 6aObB9yzU1r
InChI InChI=1S/C32H42O6/c33-29(13-17-31(18-14-29)35-21-1-2-22-36-31)27-9-5-25(6-10-27)26-7-11-28(12-8-26)30(34)15-19-32(20-16-30)37-23-3-4-24-38-32/h5-12,33-34H,1-4,13-24H2
InChIKey ARMWCPHKGQGUMK-UHFFFAOYSA-N
Mol Weight 522.7 g/mol
Molecular Formula C32H42O6
Exact Mass 522.298139 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J64461khqxT
Name 4,4'-bis(3-Hydroxy-7,12-dioxaspiro[5.6]dodecan-3-yl] biphenyl
Alternate Name(s) 3-[4'-(3-hydroxy-7,12-dioxaspiro[5.6]dodec-3-yl)[1,1'-biphenyl]-4-yl]-7,12-dioxaspiro[5.6]dodecan-3-ol
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H42O6
InChI InChI=1S/C32H42O6/c33-29(13-17-31(18-14-29)35-21-1-2-22-36-31)27-9-5-25(6-10-27)26-7-11-28(12-8-26)30(34)15-19-32(20-16-30)37-23-3-4-24-38-32/h5-12,33-34H,1-4,13-24H2
InChIKey ARMWCPHKGQGUMK-UHFFFAOYSA-N
Molecular Weight 522.682 g/mol
SMILES OC1(c2ccc(-c3ccc(C4(CCC5(OCCCCO5)CC4)O)cc3)cc2)CCC2(CC1)OCCCCO2
SPLASH splash10-004i-0900000000-dabfa3e88ab0615e4052
Source of Spectrum K-126-1731-30
Wiley ID 1402309