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(2R,5R,6R)-2-t-butyl-5-(4'-phthalimidobutyl)-5,6-dimethyl-1,3-dioxan-4-one
SpectraBase Compound ID DGaJrztDUJj
InChI InChI=1S/C22H29NO5/c1-14-22(5,19(26)28-20(27-14)21(2,3)4)12-8-9-13-23-17(24)15-10-6-7-11-16(15)18(23)25/h6-7,10-11,14,20H,8-9,12-13H2,1-5H3/t14-,20-,22-/m1/s1
InChIKey ZPQNCLWQZNGNRB-JEWAVWJGSA-N
Mol Weight 387.48 g/mol
Molecular Formula C22H29NO5
Exact Mass 387.204573 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HcJLJHnpVky
Name (2R,5R,6R)-2-t-butyl-5-(4'-phthalimidobutyl)-5,6-dimethyl-1,3-dioxan-4-one
Alternate Name(s) 2-{4-[(2R,4R,5R)-2-tert-butyl-4,5-dimethyl-6-oxo-1,3-dioxan-5-yl]butyl}-1H-isoindole-1,3(2H)-dione
CAS Registry Number 134528-92-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H29NO5
InChI InChI=1S/C22H29NO5/c1-14-22(5,19(26)28-20(27-14)21(2,3)4)12-8-9-13-23-17(24)15-10-6-7-11-16(15)18(23)25/h6-7,10-11,14,20H,8-9,12-13H2,1-5H3/t14-,20-,22-/m1/s1
InChIKey ZPQNCLWQZNGNRB-JEWAVWJGSA-N
Molecular Weight 387.476 g/mol
SMILES C1(N(C(c2ccccc12)=O)CCCC[C@]1(C(O[C@@](O[C@@]1(C)[H])(C(C)(C)C)[H])=O)C)=O
SPLASH splash10-08fr-5930000000-ce81c157dd697bc17549
Source of Spectrum K-124-1841-12
Wiley ID 1363423