For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
11-[1-(8-acetamido-5-tosyl-5-aza-octyl)2-piperidyl]undecanoic acid methylester
SpectraBase Compound ID DLNtOgg3Rbe
InChI InChI=1S/C33H57N3O5S/c1-29-20-22-32(23-21-29)42(39,40)36(28-16-24-34-30(2)37)27-15-14-26-35-25-13-12-18-31(35)17-10-8-6-4-5-7-9-11-19-33(38)41-3/h20-23,31H,4-19,24-28H2,1-3H3,(H,34,37)
InChIKey AAXDXFDPCGFOLH-UHFFFAOYSA-N
Mol Weight 607.9 g/mol
Molecular Formula C33H57N3O5S
Exact Mass 607.401893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9Ujg3VOu9uj
Name 11-[1-(8-acetamido-5-tosyl-5-aza-octyl)2-piperidyl]undecanoic acid methylester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H57N3O5S
InChI InChI=1S/C33H57N3O5S/c1-29-20-22-32(23-21-29)42(39,40)36(28-16-24-34-30(2)37)27-15-14-26-35-25-13-12-18-31(35)17-10-8-6-4-5-7-9-11-19-33(38)41-3/h20-23,31H,4-19,24-28H2,1-3H3,(H,34,37)
InChIKey AAXDXFDPCGFOLH-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.19760590839
Molecular Weight 607.895 g/mol
SMILES N(CCCN(CCCCN1CCCCC1CCCCCCCCCCC(OC)=O)S(c1ccc(C)cc1)(=O)=O)C(=O)C
SPLASH splash10-053r-9470700000-23abf23aa8ca84177ba7
Source of Spectrum H-59-3023-22
Synonyms Methyl 11-(1-(4-((N-(3-acetamidopropyl)-4-methylphenyl)sulfonamido)butyl)piperidin-2-yl)undecanoate
Wiley ID 1800011