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JWH-398 N-(4-hydroxypentyl) metabolite
SpectraBase Compound ID 14Yx60In36M
InChI InChI=1S/C24H22ClNO2/c1-16(27)7-6-14-26-15-21(19-10-4-5-11-23(19)26)24(28)20-12-13-22(25)18-9-3-2-8-17(18)20/h2-5,8-13,15-16,27H,6-7,14H2,1H3
InChIKey KDHNVFXZDOAZAI-UHFFFAOYSA-N
Mol Weight 391.9 g/mol
Molecular Formula C24H22ClNO2
Exact Mass 391.133907 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HRfipfYafnr
Name JWH-398 N-(4-hydroxypentyl) metabolite
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H22ClNO2
InChI InChI=1S/C24H22ClNO2/c1-16(27)7-6-14-26-15-21(19-10-4-5-11-23(19)26)24(28)20-12-13-22(25)18-9-3-2-8-17(18)20/h2-5,8-13,15-16,27H,6-7,14H2,1H3
InChIKey KDHNVFXZDOAZAI-UHFFFAOYSA-N
Molecular Weight 391.898 g/mol
SMILES OC(CCC[n]1cc(c2ccccc12)C(c1ccc(c2ccccc12)Cl)=O)C
SPLASH splash10-000f-3944000000-00ce39f1c39b3f219b70
Source of Spectrum SWG-33-3316-0
Synonyms (4-Chloronaphthalen-1-yl)(1-(4-hydroxypentyl)-1H-indol-3-yl)methanone
Wiley ID 1810169