2,2-Dimethyl-propionic acid (S)-2-((4S,5R,6S)-6-allyl-2,2,5-trimethyl-[1,3]dioxan-4-yl)-propyl ester

SpectraBase Compound ID	E7ZYfWrZcH2
InChI	InChI=1S/C18H32O4/c1-9-10-14-13(3)15(22-18(7,8)21-14)12(2)11-20-16(19)17(4,5)6/h9,12-15H,1,10-11H2,2-8H3/t12-,13+,14-,15-/m0/s1
InChIKey	VUMCQXBXLOAFTP-XGUBFFRZSA-N Google Search
Mol Weight	312.5 g/mol
Molecular Formula	C18H32O4
Exact Mass	312.23006 g/mol

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SpectraBase Spectrum ID	LsBhv50l5lN
Name	2,2-Dimethyl-propionic acid (S)-2-((4S,5R,6S)-6-allyl-2,2,5-trimethyl-[1,3]dioxan-4-yl)-propyl ester
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	312.230059506 u
Formula	C18H32O4
InChI	InChI=1S/C18H32O4/c1-9-10-14-13(3)15(22-18(7,8)21-14)12(2)11-20-16(19)17(4,5)6/h9,12-15H,1,10-11H2,2-8H3/t12-,13+,14-,15-/m0/s1
InChIKey	VUMCQXBXLOAFTP-XGUBFFRZSA-N
Molecular Weight	312.450 g/mol
SMILES	[C@@]1(OC(C)(C)O[C@]([C@]1(C)[H])(CC=C)[H])([C@](COC(C(C)(C)C)=O)(C)[H])[H]