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3-(Morpholin-4-yl)propyl [3-(5-Chlorofuran-2-yl)-4-phenylisoxazole-5-yl]carboxylate
SpectraBase Compound ID FWIDUK2Y3Wn
InChI InChI=1S/C21H21ClN2O5/c22-17-8-7-16(28-17)19-18(15-5-2-1-3-6-15)20(29-23-19)21(25)27-12-4-9-24-10-13-26-14-11-24/h1-3,5-8H,4,9-14H2
InChIKey JCAMPPWDUBXTRE-UHFFFAOYSA-N
Mol Weight 416.86 g/mol
Molecular Formula C21H21ClN2O5
Exact Mass 416.113899 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GppsbAryx3S
Name 3-(Morpholin-4-yl)propyl [3-(5-Chlorofuran-2-yl)-4-phenylisoxazole-5-yl]carboxylate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21ClN2O5
InChI InChI=1S/C21H21ClN2O5/c22-17-8-7-16(28-17)19-18(15-5-2-1-3-6-15)20(29-23-19)21(25)27-12-4-9-24-10-13-26-14-11-24/h1-3,5-8H,4,9-14H2
InChIKey JCAMPPWDUBXTRE-UHFFFAOYSA-N
Instrument Name HP 5995C
Ionization Type EI
Literature Reference DOI 10.1021/jm301905a
Molecular Weight 416.861 g/mol
SMILES c1(oc(cc1)Cl)-c1noc(c1-c1ccccc1)C(=O)OCCCN1CCOCC1
SPLASH splash10-0udi-0900000000-7be8fbc7b1e931be8afb
Source of Spectrum AF-56-4293-3n
Wiley ID 1854527