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(2R,3R,6S)-3-O-methoxymethyldeoxocassine
SpectraBase Compound ID FHxmp2yCjlN
InChI InChI=1S/C20H41NO2/c1-4-5-6-7-8-9-10-11-12-13-14-19-15-16-20(18(2)21-19)23-17-22-3/h18-21H,4-17H2,1-3H3/t18-,19+,20-/m1/s1
InChIKey BUXRLEIUOPNOCW-HSALFYBXSA-N
Mol Weight 327.6 g/mol
Molecular Formula C20H41NO2
Exact Mass 327.31373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GqH25t2wkXc
Name (2R,3R,6S)-3-O-methoxymethyldeoxocassine
Alternate Name(s) (2R,3R,6S)-6-dodecyl-3-(methoxymethoxy)-2-methylpiperidine
CAS Registry Number 74822-61-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H41NO2
InChI InChI=1S/C20H41NO2/c1-4-5-6-7-8-9-10-11-12-13-14-19-15-16-20(18(2)21-19)23-17-22-3/h18-21H,4-17H2,1-3H3/t18-,19+,20-/m1/s1
InChIKey BUXRLEIUOPNOCW-HSALFYBXSA-N
Molecular Weight 327.553 g/mol
SMILES N1[C@](CC[C@]([C@]1(C)[H])(OCOC)[H])(CCCCCCCCCCCC)[H]
SPLASH splash10-0a4i-0910000000-bf257497d83090df215e
Source of Spectrum AJ-58-3343-18
Wiley ID 1325702