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(6S,7S,8S)-6-[[(benzyloxy)carbonyl]amino]-7,8-bis[(methoxymethyl)oxy]nonan-2-one
SpectraBase Compound ID ASasJYgoLP1
InChI InChI=1S/C21H33NO7/c1-16(23)9-8-12-19(20(29-15-26-4)17(2)28-14-25-3)22-21(24)27-13-18-10-6-5-7-11-18/h5-7,10-11,17,19-20H,8-9,12-15H2,1-4H3,(H,22,24)/t17-,19-,20+/m0/s1
InChIKey GDBTYGFGRRANKU-YSIASYRMSA-N
Mol Weight 411.5 g/mol
Molecular Formula C21H33NO7
Exact Mass 411.225702 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fde0UxDUhxJ
Name (6S,7S,8S)-6-[[(benzyloxy)carbonyl]amino]-7,8-bis[(methoxymethyl)oxy]nonan-2-one
Alternate Name(s) benzyl (1S)-1-[(1S,2S)-1,2-bis(methoxymethoxy)propyl]-5-oxohexylcarbamate
CAS Registry Number 117941-22-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H33NO7
InChI InChI=1S/C21H33NO7/c1-16(23)9-8-12-19(20(29-15-26-4)17(2)28-14-25-3)22-21(24)27-13-18-10-6-5-7-11-18/h5-7,10-11,17,19-20H,8-9,12-15H2,1-4H3,(H,22,24)/t17-,19-,20+/m0/s1
InChIKey GDBTYGFGRRANKU-YSIASYRMSA-N
Molecular Weight 411.495 g/mol
SMILES N(C(=O)OCc1ccccc1)[C@]([C@@]([C@@](OCOC)(C)[H])(OCOC)[H])(CCCC(=O)C)[H]
SPLASH splash10-0007-9280000000-8f5522b81d90c59e0242
Source of Spectrum C-111-1406-53
Wiley ID 1374062