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JWH-031

View entire compound with spectra: 2 FTIR, 1 Raman, and 2 MS (GC)

JWH-031
SpectraBase Compound ID CszvS0ei0fJ
InChI InChI=1S/C21H23NO/c1-2-3-4-7-14-22-15-13-18(16-22)21(23)20-12-8-10-17-9-5-6-11-19(17)20/h5-6,8-13,15-16H,2-4,7,14H2,1H3
InChIKey QTWPXDHMBKIWDK-UHFFFAOYSA-N
Mol Weight 305.42 g/mol
Molecular Formula C21H23NO
Exact Mass 305.177964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LgKhwsLGx51
Name JWH-031
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23NO
InChI InChI=1S/C21H23NO/c1-2-3-4-7-14-22-15-13-18(16-22)21(23)20-12-8-10-17-9-5-6-11-19(17)20/h5-6,8-13,15-16H,2-4,7,14H2,1H3
InChIKey QTWPXDHMBKIWDK-UHFFFAOYSA-N
Molecular Weight 305.421 g/mol
SMILES c1ccc2c(c1C(c1c[n](cc1)CCCCCC)=O)cccc2
SPLASH splash10-0a6r-4954000000-408a3374bd5a3d4c6875
Source of Spectrum SWG-33-2875-0
Synonyms (1-hexyl-1H-pyrrol-3-yl)-1-naphthalenyl-methanone (1-hexyl-1H-pyrrol-3-yl)(naphthalen-1-yl)methanone
Wiley ID 1809878