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JWH-081 N-(5-hydroxypentyl) metabolite
SpectraBase Compound ID 9OSEzcYhsRc
InChI InChI=1S/C25H25NO3/c1-29-24-14-13-21(18-9-3-4-11-20(18)24)25(28)22-17-26(15-7-2-8-16-27)23-12-6-5-10-19(22)23/h3-6,9-14,17,27H,2,7-8,15-16H2,1H3
InChIKey MCDCEPNRUDLEJP-UHFFFAOYSA-N
Mol Weight 387.48 g/mol
Molecular Formula C25H25NO3
Exact Mass 387.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J0C3Tqz8ech
Name JWH-081 N-(5-hydroxypentyl) metabolite
Alternate Name(s) (1-(5-hydroxypentyl)-1H-indol-3-yl)(4-methoxynaphthalen-1-yl)methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H25NO3
InChI InChI=1S/C25H25NO3/c1-29-24-14-13-21(18-9-3-4-11-20(18)24)25(28)22-17-26(15-7-2-8-16-27)23-12-6-5-10-19(22)23/h3-6,9-14,17,27H,2,7-8,15-16H2,1H3
InChIKey MCDCEPNRUDLEJP-UHFFFAOYSA-N
Molecular Weight 387.479 g/mol
SMILES OCCCCC[n]1cc(c2ccccc12)C(c1ccc(c2ccccc12)OC)=O
SPLASH splash10-01pc-1955000000-e859546449a64f1628df
Source of Spectrum SWG-33-3317-0
Wiley ID 1810170