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MDMB-4en-PINACA
SpectraBase Compound ID 3kER4pXBZsX
InChI InChI=1S/C20H27N3O3/c1-6-7-10-13-23-15-12-9-8-11-14(15)16(22-23)18(24)21-17(19(25)26-5)20(2,3)4/h6,8-9,11-12,17H,1,7,10,13H2,2-5H3,(H,21,24)/t17-/m1/s1
InChIKey LWOCBHBFWNGPGM-QGZVFWFLSA-N
Mol Weight 357.45 g/mol
Molecular Formula C20H27N3O3
Exact Mass 357.205242 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8GwfIElP3tw
Name MDMB-4en-PINACA
Classification Indazole cannabinoid designer drug
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 357.205241738 u
Formula C20H27N3O3
InChI InChI=1S/C20H27N3O3/c1-6-7-10-13-23-15-12-9-8-11-14(15)16(22-23)18(24)21-17(19(25)26-5)20(2,3)4/h6,8-9,11-12,17H,1,7,10,13H2,2-5H3,(H,21,24)/t17-/m1/s1
InChIKey LWOCBHBFWNGPGM-QGZVFWFLSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 357.454 g/mol
Nominal Mass 357 u
Quality 978
Retention Index 2801
SMILES C=1(C=2C(N(N1)CCCC=C)=CC=CC2)C(N[C@@](C(C)(C)C)(C(OC)=O)[H])=O
SPLASH splash10-03dj-2982000000-32f132b80f0dfb0276f5
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms MDMB-4-en-PINACA MDMB-PENINACA methyl (S)-3,3-dimethyl-2-(1-(pent-4-en-1-yl)-1H-indazole-3-carboxamido)butanoate
Technique GC/MS
Wiley ID DD2024_027365