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5-Isoxazolecarboxylic acid, 2-cyclohexyl-2,3-dihydro-3-phenyl-, ethyl ester
SpectraBase Compound ID B09sdUXWNc1
InChI InChI=1S/C18H23NO3/c1-2-21-18(20)17-13-16(14-9-5-3-6-10-14)19(22-17)15-11-7-4-8-12-15/h3,5-6,9-10,13,15-16H,2,4,7-8,11-12H2,1H3
InChIKey NOFOFXSARSGTNR-UHFFFAOYSA-N
Mol Weight 301.39 g/mol
Molecular Formula C18H23NO3
Exact Mass 301.167794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EtRpUUk36h1
Name 5-Isoxazolecarboxylic acid, 2-cyclohexyl-2,3-dihydro-3-phenyl-, ethyl ester
Alternate Name(s) 2-Cyclohexyl-5-ethoxycarbonyl-3-phenyl-4-isoxazoline Ethyl 2-cyclohexyl-3-phenyl-2,3-dihydro-5-isoxazolecarboxylate
CAS Registry Number 117644-96-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23NO3
InChI InChI=1S/C18H23NO3/c1-2-21-18(20)17-13-16(14-9-5-3-6-10-14)19(22-17)15-11-7-4-8-12-15/h3,5-6,9-10,13,15-16H,2,4,7-8,11-12H2,1H3
InChIKey NOFOFXSARSGTNR-UHFFFAOYSA-N
Molecular Weight 301.386 g/mol
SMILES C=1(ON(C2CCCCC2)C(C1)c1ccccc1)C(=O)OCC
SPLASH splash10-0fi0-3291000000-195e0cc7ad711ef213ee
Source of Spectrum F-44-1253-20
Wiley ID 1303955