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4-Decene-3,6-diol, 6-butyl-1,2-dimethoxy-, 3-acetate, [S-[R*,S*-(E)]]-
SpectraBase Compound ID FbnHhlWjFrd
InChI InChI=1S/C18H34O5/c1-6-8-11-18(20,12-9-7-2)13-10-16(23-15(3)19)17(22-5)14-21-4/h10,13,16-17,20H,6-9,11-12,14H2,1-5H3/b13-10+/t16-,17+/m0/s1
InChIKey QQDDLGQXYCMHAB-GABYWQGASA-N
Mol Weight 330.5 g/mol
Molecular Formula C18H34O5
Exact Mass 330.240624 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GfD7ncQATiR
Name 4-Decene-3,6-diol, 6-butyl-1,2-dimethoxy-, 3-acetate, [S-[R*,S*-(E)]]-
Alternate Name(s) (+)-2R,3S-(E)-3-Acetoxy-6-n-butyl-1,2-dimethoxy-4-decen-6-ol (1S,2E)-4-butyl-1-[(1R)-1,2-dimethoxyethyl]-4-hydroxy-2-octenyl acetate
CAS Registry Number 59726-80-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H34O5
InChI InChI=1S/C18H34O5/c1-6-8-11-18(20,12-9-7-2)13-10-16(23-15(3)19)17(22-5)14-21-4/h10,13,16-17,20H,6-9,11-12,14H2,1-5H3/b13-10+/t16-,17+/m0/s1
InChIKey QQDDLGQXYCMHAB-GABYWQGASA-N
Molecular Weight 330.465 g/mol
SMILES OC(\C=C\[C@](OC(=O)C)([C@](OC)(COC)[H])[H])(CCCC)CCCC
SPLASH splash10-0019-9300000000-51d441d9f4450037bc44
Source of Spectrum K-109-1720-0
Wiley ID 1327875