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tert-Butyl [5-(6-Pent-2-enyl-1,4-dioxaspiro[4.4]nonan-7-yl)pentyloxy]acetate
SpectraBase Compound ID ICghM0JTjE
InChI InChI=1S/C23H40O5/c1-5-6-8-12-20-19(13-14-23(20)26-16-17-27-23)11-9-7-10-15-25-18-21(24)28-22(2,3)4/h6,8,19-20H,5,7,9-18H2,1-4H3/b8-6+/t19-,20+/m0/s1
InChIKey KMHLERXVSHCZFT-NTQLHHNMSA-N
Mol Weight 396.6 g/mol
Molecular Formula C23H40O5
Exact Mass 396.287574 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B8wajrrc8LR
Name tert-Butyl [5-(6-Pent-2-enyl-1,4-dioxaspiro[4.4]nonan-7-yl)pentyloxy]acetate
Alternate Name(s) tert-Butyl[(5-{6-[(2E)-2-pentenyl]-1,4-dioxaspiro[4.4]non-7-yl}pentyl)oxy]acetate {5-[(6R,7S)-((E)-6-Pent-2-enyl)-1,4-dioxa-spiro[4.4]non-7-yl]-pentyloxy}-acetic acid tert-butyl ester
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Formula C23H40O5
InChI InChI=1S/C23H40O5/c1-5-6-8-12-20-19(13-14-23(20)26-16-17-27-23)11-9-7-10-15-25-18-21(24)28-22(2,3)4/h6,8,19-20H,5,7,9-18H2,1-4H3/b8-6+/t19-,20+/m0/s1
InChIKey KMHLERXVSHCZFT-NTQLHHNMSA-N
Molecular Weight 396.568 g/mol
SMILES C12([C@@]([C@@](CCCCCOCC(OC(C)(C)C)=O)(CC2)[H])(C\C=C\CC)[H])OCCO1
SPLASH splash10-0006-9101000000-8939fe2300126b85d0b6
Source of Spectrum KC-0-3556-22
Wiley ID 823853