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(E)-[(4S)-4-(2-benzoxyethyl)-2,2-dimethyl-1,3-dioxan-5-ylidene]-[(2S)-2-(methoxymethyl)pyrrolidino]amine
SpectraBase Compound ID JDRPITd7iCY
InChI InChI=1S/C21H32N2O4/c1-21(2)26-16-19(22-23-12-7-10-18(23)15-24-3)20(27-21)11-13-25-14-17-8-5-4-6-9-17/h4-6,8-9,18,20H,7,10-16H2,1-3H3/b22-19+/t18-,20-/m0/s1
InChIKey CACZJJHBLZUBSL-URPGASNBSA-N
Mol Weight 376.5 g/mol
Molecular Formula C21H32N2O4
Exact Mass 376.236208 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1VAjAR26WVI
Name (E)-[(4S)-4-(2-benzoxyethyl)-2,2-dimethyl-1,3-dioxan-5-ylidene]-[(2S)-2-(methoxymethyl)pyrrolidino]amine
Alternate Name(s) (E,4S)-N-[(2S)-2-(methoxymethyl)-1-pyrrolidinyl]-2,2-dimethyl-4-(2-phenylmethoxyethyl)-1,3-dioxan-5-imine (E,4S)-4-(2-benzyloxyethyl)-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-2,2-dimethyl-1,3-dioxan-5-imine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32N2O4
InChI InChI=1S/C21H32N2O4/c1-21(2)26-16-19(22-23-12-7-10-18(23)15-24-3)20(27-21)11-13-25-14-17-8-5-4-6-9-17/h4-6,8-9,18,20H,7,10-16H2,1-3H3/b22-19+/t18-,20-/m0/s1
InChIKey CACZJJHBLZUBSL-URPGASNBSA-N
Molecular Weight 376.497 g/mol
SMILES [C@@]1(\C(=N\N2[C@](COC)(CCC2)[H])COC(O1)(C)C)(CCOCc1ccccc1)[H]
SPLASH splash10-00dm-9000000000-12dd2593e0c33030219a
Source of Spectrum SO-64-494-4
Wiley ID 1540773