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MN-18 N-(5-hydroxypentyl) metabolite

View entire compound with spectra: 2 MS (GC)

MN-18 N-(5-hydroxypentyl) metabolite
SpectraBase Compound ID 74W8g0QwtP1
InChI InChI=1S/C23H23N3O2/c27-16-7-1-6-15-26-21-14-5-4-12-19(21)22(25-26)23(28)24-20-13-8-10-17-9-2-3-11-18(17)20/h2-5,8-14,27H,1,6-7,15-16H2,(H,24,28)
InChIKey WKUSKPBWWGSRLA-UHFFFAOYSA-N
Mol Weight 373.46 g/mol
Molecular Formula C23H23N3O2
Exact Mass 373.179027 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3lo2kLo9uw9
Name MN-18 N-(5-hydroxypentyl) metabolite
Catalog Number 17785
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H23N3O2
InChI InChI=1S/C23H23N3O2/c27-16-7-1-6-15-26-21-14-5-4-12-19(21)22(25-26)23(28)24-20-13-8-10-17-9-2-3-11-18(17)20/h2-5,8-14,27H,1,6-7,15-16H2,(H,24,28)
InChIKey WKUSKPBWWGSRLA-UHFFFAOYSA-N
Molecular Weight 373.456 g/mol
SMILES OCCCCC[n]1nc(C(Nc2c3c(ccc2)cccc3)=O)c2c1cccc2
SPLASH splash10-03ka-2942000000-78690d9e38e648e231eb
Source of Spectrum CAY-2023-1192-0
Wiley ID 1889145