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9-O-(Lauryl)-iso-Aaptamine

View entire compound with spectra: 1 NMR, and 1 MS (GC)

9-O-(Lauryl)-iso-Aaptamine
SpectraBase Compound ID JhtUtr4N0sN
InChI InChI=1S/C25H34N2O3/c1-4-5-6-7-8-9-10-11-12-13-22(28)30-25-21(29-3)18-19-14-16-26-20-15-17-27(2)24(25)23(19)20/h14-18H,4-13H2,1-3H3
InChIKey BMUOPBNXDBKHPJ-UHFFFAOYSA-N
Mol Weight 410.6 g/mol
Molecular Formula C25H34N2O3
Exact Mass 410.256943 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I20XbX2e3BW
Name 9-O-(Lauryl)-iso-Aaptamine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H34N2O3
InChI InChI=1S/C25H34N2O3/c1-4-5-6-7-8-9-10-11-12-13-22(28)30-25-21(29-3)18-19-14-16-26-20-15-17-27(2)24(25)23(19)20/h14-18H,4-13H2,1-3H3
InChIKey BMUOPBNXDBKHPJ-UHFFFAOYSA-N
Molecular Weight 410.558 g/mol
SMILES c12c(c(OC)cc3c2c(ncc3)C=CN1C)OC(=O)CCCCCCCCCCC
SPLASH splash10-004i-7490000000-c41a449e3e43ce70f55a
Source of Spectrum G4-62-1266-11
Wiley ID 1608031