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(3RS,4SR,5RS,6RS,7RS)-5,7-Dihydroxy-2,4,6-trimethylnonan-3-yl propionate
SpectraBase Compound ID HcfKye2gJyF
InChI InChI=1S/C15H30O4/c1-7-12(16)10(5)14(18)11(6)15(9(3)4)19-13(17)8-2/h9-12,14-16,18H,7-8H2,1-6H3/t10-,11+,12-,14-,15-/m1/s1
InChIKey OOZPBSKGNKVZST-BUONHZGMSA-N
Mol Weight 274.4 g/mol
Molecular Formula C15H30O4
Exact Mass 274.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ED5w63ohVhw
Name (3RS,4SR,5RS,6RS,7RS)-5,7-Dihydroxy-2,4,6-trimethylnonan-3-yl propionate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H30O4
InChI InChI=1S/C15H30O4/c1-7-12(16)10(5)14(18)11(6)15(9(3)4)19-13(17)8-2/h9-12,14-16,18H,7-8H2,1-6H3/t10-,11+,12-,14-,15-/m1/s1
InChIKey OOZPBSKGNKVZST-BUONHZGMSA-N
Molecular Weight 274.401 g/mol
SMILES O[C@@]([C@]([C@]([C@@]([C@](OC(=O)CC)(C(C)C)[H])(C)[H])(O)[H])(C)[H])(CC)[H]
SPLASH splash10-0a5a-9540000000-b75498316eb2a236e43e
Source of Spectrum KC-0-2268-10
Synonyms 3,5-Dihydroxy-1-isopropyl-2,4-dimethylheptyl propionate Propionic acid (1R,2S,3R,4R,5R)-3,5-dihydroxy-1-isopropyl-2,4-dimethyl-heptyl ester Propanoic acid [(3R,4S,5R,6R,7R)-5,7-dihydroxy-2,4,6-trimethylnonan-3-yl] ester [(3R,4S,5R,6R,7R)-5,7-dihydroxy-2,4,6-trimethylnonan-3-yl] propanoate [(1R,2S,3R,4R,5R)-3,5-dihydroxy-1-isopropyl-2,4-dimethyl-heptyl] propanoate [(3R,4S,5R,6R,7R)-2,4,6-trimethyl-5,7-bis(oxidanyl)nonan-3-yl] propanoate
Wiley ID 831295