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(1S,15R,16S,18R,19R)-19-butoxy-18-(butoxymethyl)-16-methoxy-8-phenethyl-2,5,11,14,17-pentaoxa-8-azabicyclo[13.4.0]nonadecane

View entire compound with spectra: 1 MS (GC)

(1S,15R,16S,18R,19R)-19-butoxy-18-(butoxymethyl)-16-methoxy-8-phenethyl-2,5,11,14,17-pentaoxa-8-azabicyclo[13.4.0]nonadecane
SpectraBase Compound ID 98am5uYGPwU
InChI InChI=1S/C31H53NO8/c1-4-6-17-36-25-27-28(37-18-7-5-2)29-30(31(33-3)40-27)39-24-22-35-20-16-32(15-19-34-21-23-38-29)14-13-26-11-9-8-10-12-26/h8-12,27-31H,4-7,13-25H2,1-3H3/t27-,28-,29+,30-,31+/m1/s1
InChIKey SEDCGRFNNYBRJO-SAEUYMBFSA-N
Mol Weight 567.8 g/mol
Molecular Formula C31H53NO8
Exact Mass 567.377118 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2sVwaXtrxPm
Name (1S,15R,16S,18R,19R)-19-butoxy-18-(butoxymethyl)-16-methoxy-8-phenethyl-2,5,11,14,17-pentaoxa-8-azabicyclo[13.4.0]nonadecane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H53NO8
InChI InChI=1S/C31H53NO8/c1-4-6-17-36-25-27-28(37-18-7-5-2)29-30(31(33-3)40-27)39-24-22-35-20-16-32(15-19-34-21-23-38-29)14-13-26-11-9-8-10-12-26/h8-12,27-31H,4-7,13-25H2,1-3H3/t27-,28-,29+,30-,31+/m1/s1
InChIKey SEDCGRFNNYBRJO-SAEUYMBFSA-N
Molecular Weight 567.764 g/mol
SMILES [C@@]12([C@]([C@](OCCCC)([C@](O[C@@]2(OC)[H])(COCCCC)[H])[H])(OCCOCCN(CCOCCO1)CCc1ccccc1)[H])[H]
SPLASH splash10-0a70-0900880000-ad165120b3be8f202ec7
Source of Spectrum KC-0-3654-11
Wiley ID 829635