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Methyl (R)-2-(1-(5-fluoropentyl)-1H-indazole-3-carboxamido)-3,3-dimethylbutanoate
SpectraBase Compound ID DnMa0hbyGeF
InChI InChI=1S/C20H28FN3O3/c1-20(2,3)17(19(26)27-4)22-18(25)16-14-10-6-7-11-15(14)24(23-16)13-9-5-8-12-21/h6-7,10-11,17H,5,8-9,12-13H2,1-4H3,(H,22,25)/t17-/m0/s1
InChIKey PWEKNGSNNAKWBL-KRWDZBQOSA-N
Mol Weight 377.46 g/mol
Molecular Formula C20H28FN3O3
Exact Mass 377.21147 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kb1Hko1H8B
Name Methyl (R)-2-(1-(5-fluoropentyl)-1H-indazole-3-carboxamido)-3,3-dimethylbutanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28FN3O3
InChI InChI=1S/C20H28FN3O3/c1-20(2,3)17(19(26)27-4)22-18(25)16-14-10-6-7-11-15(14)24(23-16)13-9-5-8-12-21/h6-7,10-11,17H,5,8-9,12-13H2,1-4H3,(H,22,25)/t17-/m0/s1
InChIKey PWEKNGSNNAKWBL-KRWDZBQOSA-N
Literature Reference DOI 10.1016/j.forsciint.2016.10.023
Molecular Weight 377.460 g/mol
SMILES N(C(c1n[n](c2ccccc12)CCCCCF)=O)[C@@](C(OC)=O)(C(C)(C)C)[H]
SPLASH splash10-001i-6793000000-add8e1493059694cf146
Source of Spectrum Nico Langer, et al. Forensic Science International, 10.1016/j.forsciint.2016.10.023
Wiley ID 1816746