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(1'R,3'R)-1,1-Bis[3'-(benzyloxy)-1'-methylbutoxy]heptane

View entire compound with spectra: 1 MS (GC)

(1'R,3'R)-1,1-Bis[3'-(benzyloxy)-1'-methylbutoxy]heptane
SpectraBase Compound ID I7s6TFu8GFf
InChI InChI=1S/C31H48O4/c1-6-7-8-15-20-31(34-27(4)21-25(2)32-23-29-16-11-9-12-17-29)35-28(5)22-26(3)33-24-30-18-13-10-14-19-30/h9-14,16-19,25-28,31H,6-8,15,20-24H2,1-5H3/t25-,26?,27-,28?,31?/m1/s1
InChIKey PTEWEWLHVXSVMZ-FWGIYDJVSA-N
Mol Weight 484.7 g/mol
Molecular Formula C31H48O4
Exact Mass 484.35526 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3fPi0qQ9yJD
Name (1'R,3'R)-1,1-Bis[3'-(benzyloxy)-1'-methylbutoxy]heptane
Alternate Name(s) (3R,5R)-7-hexyl-3,5,9,11-tetramethyl-1,13-diphenyl-2,6,8,12-tetraoxatridecane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H48O4
InChI InChI=1S/C31H48O4/c1-6-7-8-15-20-31(34-27(4)21-25(2)32-23-29-16-11-9-12-17-29)35-28(5)22-26(3)33-24-30-18-13-10-14-19-30/h9-14,16-19,25-28,31H,6-8,15,20-24H2,1-5H3/t25-,26?,27-,28?,31?/m1/s1
InChIKey PTEWEWLHVXSVMZ-FWGIYDJVSA-N
Molecular Weight 484.721 g/mol
SMILES C(O[C@@](C[C@](OCc1ccccc1)(C)[H])(C)[H])(OC(CC(OCc1ccccc1)C)C)CCCCCC
SPLASH splash10-004l-4900000000-9d5f9d1e03d1fed3baf8
Source of Spectrum C-113-8107-7
Wiley ID 1396147