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Methyl 2-(1-(5-fluoropentyl)-1H-indazole-3-carboxamido)-3,3-dimethylbutanoate
SpectraBase Compound ID AqKvpS1LlXO
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)
InChIKey PWEKNGSNNAKWBL-UHFFFAOYSA-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 3LAY9Wg94fZ
Name Methyl 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)
InChIKey PWEKNGSNNAKWBL-UHFFFAOYSA-N
Literature Reference DOI 10.1016/j.forsciint.2016.05.031
Molecular Weight 377.460 g/mol
SMILES N(C(c1n[n](c2ccccc12)CCCCCF)=O)C(C(=O)OC)C(C)(C)C
SPLASH splash10-001i-1593000000-62ed054badc9d6f74378
Source of Spectrum V. Angerer, et al. Forensic Science International, 10.1016/j.forsciint.2016.05.031
Wiley ID 1815230