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MEP-FUBINACA
SpectraBase Compound ID CqDo8qRl40C
InChI InChI=1S/C21H22FN3O3/c1-3-6-17(21(27)28-2)23-20(26)19-16-7-4-5-8-18(16)25(24-19)13-14-9-11-15(22)12-10-14/h4-5,7-12,17H,3,6,13H2,1-2H3,(H,23,26)/t17-/m0/s1
InChIKey MFRTXWHFMBIWRY-KRWDZBQOSA-N
Mol Weight 383.42 g/mol
Molecular Formula C21H22FN3O3
Exact Mass 383.16452 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID Av3GVRU7iK
Name MEP-FUBINACA
Source of Sample Cayman Chemical Company
Catalog Number 21654
Lot Number 0521014-2
Accessory DurasamplIR II
Acronyms MMB-FUBINACA isomer 1
Apodization Function Norton-Beer, medium
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Formula C21H22FN3O3
IUPAC Name Methyl (S)-2-(1-(4-fluorobenzyl)-1H-indazole-3-carboxamido)pentanoate
InChI InChI=1S/C21H22FN3O3/c1-3-6-17(21(27)28-2)23-20(26)19-16-7-4-5-8-18(16)25(24-19)13-14-9-11-15(22)12-10-14/h4-5,7-12,17H,3,6,13H2,1-2H3,(H,23,26)/t17-/m0/s1
InChIKey MFRTXWHFMBIWRY-KRWDZBQOSA-N
Instrument Name Bio-Rad FTS
SMILES N(C(c1c2ccccc2[n](n1)Cc1ccc(cc1)F)=O)[C@](C(OC)=O)(CCC)[H]
Scan Speed (number) 5
Solvent Dichloromethane
Source of Spectrum Forensic Spectral Research
Technique ATR-Film