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6-[(2-hydroxy-ethyl)-(5-octyloxycarbonyl-pentyl)-amino]-hexanoic acid octyl ester

View entire compound with spectra: 2 MS (GC)

6-[(2-hydroxy-ethyl)-(5-octyloxycarbonyl-pentyl)-amino]-hexanoic acid octyl ester
SpectraBase Compound ID E5YshynoWCr
InChI InChI=1S/C30H59NO5/c1-3-5-7-9-11-19-27-35-29(33)21-15-13-17-23-31(25-26-32)24-18-14-16-22-30(34)36-28-20-12-10-8-6-4-2/h32H,3-28H2,1-2H3
InChIKey CBUUIHAUWWFJAC-UHFFFAOYSA-N
Mol Weight 513.8 g/mol
Molecular Formula C30H59NO5
Exact Mass 513.439324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CoCwmbi7bdR
Name 6-[(2-hydroxy-ethyl)-(5-octyloxycarbonyl-pentyl)-amino]-hexanoic acid octyl ester
Alternate Name(s) Octyl 6-{(2-hydroxyethyl)[6-(octyloxy)-6-oxohexyl]amino}hexanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H59NO5
InChI InChI=1S/C30H59NO5/c1-3-5-7-9-11-19-27-35-29(33)21-15-13-17-23-31(25-26-32)24-18-14-16-22-30(34)36-28-20-12-10-8-6-4-2/h32H,3-28H2,1-2H3
InChIKey CBUUIHAUWWFJAC-UHFFFAOYSA-N
Molecular Weight 513.804 g/mol
SMILES OCCN(CCCCCC(=O)OCCCCCCCC)CCCCCC(=O)OCCCCCCCC
SPLASH splash10-001i-9467800000-afb671165ef5fd28b171
Wiley ID 1487267