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3-Nonene-1,2,5-triol, 5-butyl-, 1,2-diacetate, [S-(Z)]-
SpectraBase Compound ID GGsLPPrJ5UL
InChI InChI=1S/C17H30O5/c1-5-7-10-17(20,11-8-6-2)12-9-16(22-15(4)19)13-21-14(3)18/h9,12,16,20H,5-8,10-11,13H2,1-4H3/b12-9-/t16-/m0/s1
InChIKey JGPRRCWLNSNPNV-CKDIWJPDSA-N
Mol Weight 314.42 g/mol
Molecular Formula C17H30O5
Exact Mass 314.209324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 28pg2x13gx0
Name 3-Nonene-1,2,5-triol, 5-butyl-, 1,2-diacetate, [S-(Z)]-
Alternate Name(s) (-)-S-(Z)-1,2-diacetoxy-5-n-butyl-3-nonen-5-ol (2S,3Z)-2-(acetyloxy)-5-butyl-5-hydroxy-3-nonenyl acetate
CAS Registry Number 59726-83-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H30O5
InChI InChI=1S/C17H30O5/c1-5-7-10-17(20,11-8-6-2)12-9-16(22-15(4)19)13-21-14(3)18/h9,12,16,20H,5-8,10-11,13H2,1-4H3/b12-9-/t16-/m0/s1
InChIKey JGPRRCWLNSNPNV-CKDIWJPDSA-N
Molecular Weight 314.422 g/mol
SMILES OC(\C=C/[C@](OC(=O)C)(COC(=O)C)[H])(CCCC)CCCC
SPLASH splash10-000i-2900000000-e060b344fcb668ae497c
Source of Spectrum K-109-1721-0
Wiley ID 1315036