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AB-FUBINACA 2'-indazole isomer
SpectraBase Compound ID 7FOS5yj2Awg
InChI InChI=1S/C20H21FN4O2/c1-12(2)17(19(22)26)23-20(27)18-15-5-3-4-6-16(15)24-25(18)11-13-7-9-14(21)10-8-13/h3-10,12,17H,11H2,1-2H3,(H2,22,26)(H,23,27)/t17-/m0/s1
InChIKey XFYTVZNCYIVYKQ-KRWDZBQOSA-N
Mol Weight 368.41 g/mol
Molecular Formula C20H21FN4O2
Exact Mass 368.164854 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5DW5uX3aStt
Name AB-FUBINACA 2'-indazole isomer
Alternate Name(s) (S)-N-(1-amino-3-methyl-1-oxobutan-2-yl)-2-(4-fluorobenzyl)-2H-indazole-3-carboxamide
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Formula C20H21FN4O2
InChI InChI=1S/C20H21FN4O2/c1-12(2)17(19(22)26)23-20(27)18-15-5-3-4-6-16(15)24-25(18)11-13-7-9-14(21)10-8-13/h3-10,12,17H,11H2,1-2H3,(H2,22,26)(H,23,27)/t17-/m0/s1
InChIKey XFYTVZNCYIVYKQ-KRWDZBQOSA-N
Molecular Weight 368.412 g/mol
SMILES N(C(c1c2ccccc2n[n]1Cc1ccc(cc1)F)=O)[C@](C(N)=O)(C(C)C)[H]
SPLASH splash10-0pb9-2980000000-772715b20669bec848c1
Source of Spectrum SWG-33-4865-0
Wiley ID 1811452