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5F-ADBICA

View entire compound with spectra: 3 MS (GC)

5F-ADBICA
SpectraBase Compound ID CZyRhVAYiZ8
InChI InChI=1S/C20H28FN3O2/c1-20(2,3)17(18(22)25)23-19(26)15-13-24(12-8-4-7-11-21)16-10-6-5-9-14(15)16/h5-6,9-10,13,17H,4,7-8,11-12H2,1-3H3,(H2,22,25)(H,23,26)/t17-/m0/s1
InChIKey ITZSOCZDFSHNCL-KRWDZBQOSA-N
Mol Weight 361.46 g/mol
Molecular Formula C20H28FN3O2
Exact Mass 361.216555 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CECTC1dE7hr
Name 5-Fluoro-ADBICA
Alternate Name(s) N-(1-amino-3,3-dimethyl-1-oxobutan-2-yl)-1-(5-fluoropentyl)-1H-indole-3-carboxamide 5F-ADBICA (R)-N-(1-amino-3,3-dimethyl-1-oxobutan-2-yl)-1-(5-fluoropentyl)-1H-indole-3-carboxamide
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Formula C20H28FN3O2
InChI InChI=1S/C20H28FN3O2/c1-20(2,3)17(18(22)25)23-19(26)15-13-24(12-8-4-7-11-21)16-10-6-5-9-14(15)16/h5-6,9-10,13,17H,4,7-8,11-12H2,1-3H3,(H2,22,25)(H,23,26)/t17-/m0/s1
InChIKey ITZSOCZDFSHNCL-KRWDZBQOSA-N
Molecular Weight 361.461 g/mol
SMILES N(C(c1c2ccccc2[n](c1)CCCCCF)=O)[C@@](C(N)=O)(C(C)(C)C)[H]
SPLASH splash10-001i-1390000000-b73911af8fbc24c692eb
Source of Spectrum SWG-33-4242-0
Wiley ID 1810864