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MDMB-FUBICA metabolite 3
SpectraBase Compound ID 8nsJP9WnIwn
InChI InChI=1S/C22H23FN2O3/c1-22(2,3)19(21(27)28)24-20(26)17-13-25(18-7-5-4-6-16(17)18)12-14-8-10-15(23)11-9-14/h4-11,13,19H,12H2,1-3H3,(H,24,26)(H,27,28)/t19-/m1/s1
InChIKey PZPKPULZRMBYJZ-LJQANCHMSA-N
Mol Weight 382.44 g/mol
Molecular Formula C22H23FN2O3
Exact Mass 382.169271 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CoMVzMnWPBO
Name MDMB-FUBICA metabolite 3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H23FN2O3
InChI InChI=1S/C22H23FN2O3/c1-22(2,3)19(21(27)28)24-20(26)17-13-25(18-7-5-4-6-16(17)18)12-14-8-10-15(23)11-9-14/h4-11,13,19H,12H2,1-3H3,(H,24,26)(H,27,28)/t19-/m1/s1
InChIKey PZPKPULZRMBYJZ-LJQANCHMSA-N
Molecular Weight 382.435 g/mol
SMILES N(C(=O)c1c[n](Cc2ccc(F)cc2)c2c1cccc2)[C@](C(O)=O)(C(C)(C)C)[H]
SPLASH splash10-0a4i-2935000000-22c4081851b7cb144b68
Source of Spectrum SWG-33-4596-0
Synonyms (S)-2-(1-(4-fluorobenzyl)-1H-indole-3-carboxamido)-3,3-dimethylbutanoic acid
Wiley ID 1811194