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(6S,7S,8S)-6-(benzylamino)-7,8-bis[(methoxymethyl)oxy]-2-nonene
SpectraBase Compound ID HckQiJb9v80
InChI InChI=1S/C20H33NO4/c1-5-6-8-13-19(21-14-18-11-9-7-10-12-18)20(25-16-23-4)17(2)24-15-22-3/h5-7,9-12,17,19-21H,8,13-16H2,1-4H3/b6-5+/t17-,19-,20+/m0/s1
InChIKey UVQKINSSLYONBS-HXIOPBFGSA-N
Mol Weight 351.5 g/mol
Molecular Formula C20H33NO4
Exact Mass 351.240959 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9cPQI0qB6Sb
Name (6S,7S,8S)-6-(benzylamino)-7,8-bis[(methoxymethyl)oxy]-2-nonene
Alternate Name(s) (2S,3S,4S,7E)-N-benzyl-2,3-bis(methoxymethoxy)-7-nonen-4-amine N-benzyl-N-{(1S,4E)-1-[(1S,2S)-1,2-bis(methoxymethoxy)propyl]-4-hexenyl}amine
CAS Registry Number 117941-23-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H33NO4
InChI InChI=1S/C20H33NO4/c1-5-6-8-13-19(21-14-18-11-9-7-10-12-18)20(25-16-23-4)17(2)24-15-22-3/h5-7,9-12,17,19-21H,8,13-16H2,1-4H3/b6-5+/t17-,19-,20+/m0/s1
InChIKey UVQKINSSLYONBS-HXIOPBFGSA-N
Molecular Weight 351.487 g/mol
SMILES N([C@]([C@@]([C@@](OCOC)(C)[H])(OCOC)[H])(CC\C=C\C)[H])Cc1ccccc1
SPLASH splash10-000l-7900000000-27e754cc6c732a24d430
Source of Spectrum C-111-1406-55
Wiley ID 1342655