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1,6-Dioxaspiro[4.5]decane, butanoic acid deriv.

View entire compound with spectra: 1 MS (GC)

1,6-Dioxaspiro[4.5]decane, butanoic acid deriv.
SpectraBase Compound ID A1b81yYc0Ss
InChI InChI=1S/C19H24O5/c1-4-5-6-7-10-15-17(23-16(20)13-14(2)3)18(21)19(24-15)11-8-9-12-22-19/h10,14,17-18,21H,8-9,11-13H2,1-3H3/b15-10+/t17-,18+,19-/m1/s1
InChIKey LEOZNWWIPMVKHH-NFNYSAHWSA-N
Mol Weight 332.4 g/mol
Molecular Formula C19H24O5
Exact Mass 332.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AEQAxCcIDcK
Name 1,6-Dioxaspiro[4.5]decane, butanoic acid deriv.
Alternate Name(s) Butanoic acid, 3-methyl-, 2-(2,4-hexadiynylidene)-4-hydroxy-1,6-dioxaspiro[4.5]dec-3-yl ester, (2E,3.alpha.,4.beta.,5.beta.)-(+)- (+)-(3S*,4S*,5R*)-(E)-4-Hydroxy-3-isovaleroyloxy-2-(hexa-2,4-diynyliden)-1,6-dioxaspiro[4,5]decane (2E,3S,4S,5R)-2-(hexa-2,4-diyn-1-ylidene)-4-hydroxy-1,6-dioxaspiro[4.5]decan-3-yl 3-methylbutanoate 3-Methylbutanoic acid[(1S,2S,3E,5R)-3-hexa-2,4-diynylidene-1-hydroxy-4,10-dioxaspiro[4.5]decan-2-yl]ester 3-Methylbutyric acid[(1S,2S,3E,5R)-3-hexa-2,4-diynylidene-1-hydroxy-4,10-dioxaspiro[4.5]decan-2-yl]ester [(1S,2S,3E,5R)-3-hexa-2,4-diynylidene-1-hydroxy-4,10-dioxaspiro[4.5]decan-2-yl]3-methylbutanoate [(1S,2S,3E,5R)-3-hexa-2,4-diynylidene-1-oxidanyl-4,10-dioxaspiro[4.5]decan-2-yl]3-methylbutanoate 3-Methylbutanoic acid [(2E,3S,4S,5R)-2-hexa-2,4-diynylidene-4-hydroxy-1,10-dioxaspiro[4.5]decan-3-yl] ester [(2E,3S,4S,5R)-2-hexa-2,4-diynylidene-4-hydroxy-1,10-dioxaspiro[4.5]decan-3-yl] 3-methylbutanoate [(2E,3S,4S,5R)-2-hexa-2,4-diynylidene-4-oxidanyl-1,10-dioxaspiro[4.5]decan-3-yl] 3-methylbutanoate
CAS Registry Number 132152-25-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H24O5
InChI InChI=1S/C19H24O5/c1-4-5-6-7-10-15-17(23-16(20)13-14(2)3)18(21)19(24-15)11-8-9-12-22-19/h10,14,17-18,21H,8-9,11-13H2,1-3H3/b15-10+/t17-,18+,19-/m1/s1
InChIKey LEOZNWWIPMVKHH-NFNYSAHWSA-N
Molecular Weight 332.396 g/mol
SMILES O[C@@]1([C@@]2(O\C(=C\C#CC#CC)[C@]1(OC(=O)CC(C)C)[H])OCCCC2)[H]
SPLASH splash10-059i-5910000000-972aca63421adf52b32d
Source of Spectrum F-46-6937-2
Wiley ID 1329481