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2-((4R,6S)-1,4-Dimethyl-3-(trifluoromethyl)-1,4,5,6-tetrahydropyrano[2,3-c]pyrazol-6-yl)-1-(3-methoxyphenyl)ethanone
SpectraBase Compound ID IkehgwKZU45
InChI InChI=1S/C18H19F3N2O3/c1-10-7-13(9-14(24)11-5-4-6-12(8-11)25-3)26-17-15(10)16(18(19,20)21)22-23(17)2/h4-6,8,10,13H,7,9H2,1-3H3/t10-,13+/m1/s1
InChIKey KOPIADUXUHAVJH-MFKMUULPSA-N
Mol Weight 368.36 g/mol
Molecular Formula C18H19F3N2O3
Exact Mass 368.134777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AB3oAuDoWb7
Name 2-((4R,6S)-1,4-Dimethyl-3-(trifluoromethyl)-1,4,5,6-tetrahydropyrano[2,3-c]pyrazol-6-yl)-1-(3-methoxyphenyl)ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19F3N2O3
InChI InChI=1S/C18H19F3N2O3/c1-10-7-13(9-14(24)11-5-4-6-12(8-11)25-3)26-17-15(10)16(18(19,20)21)22-23(17)2/h4-6,8,10,13H,7,9H2,1-3H3/t10-,13+/m1/s1
InChIKey KOPIADUXUHAVJH-MFKMUULPSA-N
Literature Reference DOI 10.1021/ol301983f
Molecular Weight 368.356 g/mol
SMILES c1c(OC)cc(cc1)C(=O)C[C@]1(Oc2c([C@@](C1)(C)[H])c(n[n]2C)C(F)(F)F)[H]
SPLASH splash10-000i-0902000000-831c1b24efb40bf9cb98
Source of Spectrum A1-14-4254/SMS5-13a
Wiley ID 1750544