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2,4,6-Tri(2,6-dimethylheptyl)-1,3,5-trioxane
SpectraBase Compound ID CJXtp53Gga2
InChI InChI=1S/C30H60O3/c1-22(2)13-10-16-25(7)19-28-31-29(20-26(8)17-11-14-23(3)4)33-30(32-28)21-27(9)18-12-15-24(5)6/h22-30H,10-21H2,1-9H3
InChIKey IQVNLKGCEDTBTJ-UHFFFAOYSA-N
Mol Weight 468.8 g/mol
Molecular Formula C30H60O3
Exact Mass 468.454246 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EosjfcY7ZXC
Name 2,4,6-Tri(2,6-dimethylheptyl)-1,3,5-trioxane
Alternate Name(s) 2,4,6-tris(2,6-dimethylheptyl)-1,3,5-trioxane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H60O3
InChI InChI=1S/C30H60O3/c1-22(2)13-10-16-25(7)19-28-31-29(20-26(8)17-11-14-23(3)4)33-30(32-28)21-27(9)18-12-15-24(5)6/h22-30H,10-21H2,1-9H3
InChIKey IQVNLKGCEDTBTJ-UHFFFAOYSA-N
Molecular Weight 468.807 g/mol
SMILES C1(OC(OC(O1)CC(CCCC(C)C)C)CC(CCCC(C)C)C)CC(CCCC(C)C)C
SPLASH splash10-067i-9402000000-52b82ab3ad8185025a5d
Source of Spectrum KC-57-6185-7
Wiley ID 1625137