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4-[5-(4-Fluorophenyl)-3-isopropylisoxazol-4-yl]-pyridin-2-yl-propylamine
SpectraBase Compound ID 5El0gL5HsKt
InChI InChI=1S/C20H22FN3O/c1-4-10-22-17-12-15(9-11-23-17)18-19(13(2)3)24-25-20(18)14-5-7-16(21)8-6-14/h5-9,11-13H,4,10H2,1-3H3,(H,22,23)
InChIKey CNUIRWBGCLOPSE-UHFFFAOYSA-N
Mol Weight 339.41 g/mol
Molecular Formula C20H22FN3O
Exact Mass 339.174691 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EarpsDIGPls
Name 4-[5-(4-Fluorophenyl)-3-isopropylisoxazol-4-yl]-pyridin-2-yl-propylamine
Alternate Name(s) 4-(5-(4-fluorophenyl)-3-isopropylisoxazol-4-yl)-N-propylpyridin-2-amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22FN3O
InChI InChI=1S/C20H22FN3O/c1-4-10-22-17-12-15(9-11-23-17)18-19(13(2)3)24-25-20(18)14-5-7-16(21)8-6-14/h5-9,11-13H,4,10H2,1-3H3,(H,22,23)
InChIKey CNUIRWBGCLOPSE-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cmdc.200500025
Molecular Weight 339.414 g/mol
SMILES N(c1nccc(-c2c(-c3ccc(cc3)F)onc2C(C)C)c1)CCC
SPLASH splash10-03ka-0249000000-101d776191aa8840e692
Source of Spectrum CMC-1-205-11a
Wiley ID 1771441