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1,4-Dioxaspiro[4.5]decane, benzoic acid deriv.
SpectraBase Compound ID 7wkrzTGCep5
InChI InChI=1S/C26H40O7/c1-16(2)18-14-19(21(24(27)31-8)23(30-7)22(18)29-6)20(28-5)13-17-15-26(32-11-12-33-26)10-9-25(17,3)4/h14,16-17,20H,9-13,15H2,1-8H3/t17-,20+/m0/s1
InChIKey FEDOISIFHLKNCE-FXAWDEMLSA-N
Mol Weight 464.6 g/mol
Molecular Formula C26H40O7
Exact Mass 464.277404 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8heaoeNlT3h
Name 1,4-Dioxaspiro[4.5]decane, benzoic acid deriv.
Alternate Name(s) Benzoic acid, 6-[2-(8,8-dimethyl-1,4-dioxaspiro[4.5]dec-7-yl)-1-methoxyethyl]-2,3-dimethoxy-4-(1-methylethyl)-, methyl ester, (R*,S*)-(.+-.)- 1-(2-(1,8-dioxaspiro[4.5]decyl)-1-methoxyeth-1-yl-3,4-dimethoxy-2-methoxycarbonyl-5-(dimethyl)methylbenzene Methyl 6-{(1R)-2-[(7S)-8,8-dimethyl-1,4-dioxaspiro[4.5]dec-7-yl]-1-methoxyethyl}-4-isopropyl-2,3-dimethoxybenzoate
CAS Registry Number 118088-44-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H40O7
InChI InChI=1S/C26H40O7/c1-16(2)18-14-19(21(24(27)31-8)23(30-7)22(18)29-6)20(28-5)13-17-15-26(32-11-12-33-26)10-9-25(17,3)4/h14,16-17,20H,9-13,15H2,1-8H3/t17-,20+/m0/s1
InChIKey FEDOISIFHLKNCE-FXAWDEMLSA-N
Molecular Weight 464.599 g/mol
SMILES c1(c(cc(c(c1OC)OC)C(C)C)[C@@](C[C@@]1(C(CCC2(C1)OCCO2)(C)C)[H])(OC)[H])C(=O)OC
SPLASH splash10-001r-0690000000-6658226299ef0af1cb96
Source of Spectrum F-43-5779-11
Wiley ID 1391517