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4Cl-MDMB-BICA
SpectraBase Compound ID 8Zg4rAR0yQj
InChI InChI=1S/C20H27ClN2O3/c1-20(2,3)17(19(25)26-4)22-18(24)15-13-23(12-8-7-11-21)16-10-6-5-9-14(15)16/h5-6,9-10,13,17H,7-8,11-12H2,1-4H3,(H,22,24)/t17-/m0/s1
InChIKey AVOZNDFOMNISOO-KRWDZBQOSA-N
Mol Weight 378.9 g/mol
Molecular Formula C20H27ClN2O3
Exact Mass 378.17102 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Do3Jr1KHYCu
Name 4Cl-MDMB-BICA
Classification Indolcarboxamide cannabinoid designer drug
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 378.171020434 u
Formula C20H27ClN2O3
InChI InChI=1S/C20H27ClN2O3/c1-20(2,3)17(19(25)26-4)22-18(24)15-13-23(12-8-7-11-21)16-10-6-5-9-14(15)16/h5-6,9-10,13,17H,7-8,11-12H2,1-4H3,(H,22,24)/t17-/m0/s1
InChIKey AVOZNDFOMNISOO-KRWDZBQOSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 378.900 g/mol
Nominal Mass 378 u
Quality 965
Retention Index 2832
SMILES C=1(C=2C(N(C1)CCCCCl)=CC=CC2)C(N[C@](C(C)(C)C)(C(OC)=O)[H])=O
SPLASH splash10-00lu-1492000000-ce24e1275010ae45ec48
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Methyl (2S)-2-(((1-(4-chlorobutyl)-1H-indol-3-yl)carbonyl)amino)-3,3-dimethylbutanoate
Technique GC/MS
Wiley ID DD2024_030708