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(3S,4R,5R,6S)-N-Benzyl-4,5-O-bistetrahydropyranyl-3,6-dihydroxyazepane
SpectraBase Compound ID FM2hcZpsqEt
InChI InChI=1S/C23H35NO6/c25-18-15-24(14-17-8-2-1-3-9-17)16-19(26)23(30-21-11-5-7-13-28-21)22(18)29-20-10-4-6-12-27-20/h1-3,8-9,18-23,25-26H,4-7,10-16H2/t18-,19-,20?,21?,22+,23+/m0/s1
InChIKey HVUIWOZTKIMMSP-VJYAMUDISA-N
Mol Weight 421.5 g/mol
Molecular Formula C23H35NO6
Exact Mass 421.246438 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EB8VyAAIz1o
Name (3S,4R,5R,6S)-N-Benzyl-4,5-O-bistetrahydropyranyl-3,6-dihydroxyazepane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H35NO6
InChI InChI=1S/C23H35NO6/c25-18-15-24(14-17-8-2-1-3-9-17)16-19(26)23(30-21-11-5-7-13-28-21)22(18)29-20-10-4-6-12-27-20/h1-3,8-9,18-23,25-26H,4-7,10-16H2/t18-,19-,20?,21?,22+,23+/m0/s1
InChIKey HVUIWOZTKIMMSP-VJYAMUDISA-N
Molecular Weight 421.534 g/mol
SMILES O[C@@]1([C@]([C@@]([C@](CN(C1)Cc1ccccc1)(O)[H])(OC1OCCCC1)[H])(OC1OCCCC1)[H])[H]
SPLASH splash10-0006-9003000000-6389af0c0be16a975b8a
Source of Spectrum Y1-36-224-1
Wiley ID 1526982