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isoxazole, 4-[4,5-dihydro-4-(methoxymethyl)-5-phenyl]-2-oxazolyl]-5-ethyl-3-phenyl-, (4S-trans)-
SpectraBase Compound ID 1PPHWz9w1rZ
InChI InChI=1S/C22H22N2O3/c1-3-18-19(20(24-27-18)15-10-6-4-7-11-15)22-23-17(14-25-2)21(26-22)16-12-8-5-9-13-16/h4-13,17,21H,3,14H2,1-2H3/t17-,21-/m0/s1
InChIKey HTHBHLCNOCYLJX-UWJYYQICSA-N
Mol Weight 362.43 g/mol
Molecular Formula C22H22N2O3
Exact Mass 362.163043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6le5j08DnQk
Name isoxazole, 4-[4,5-dihydro-4-(methoxymethyl)-5-phenyl]-2-oxazolyl]-5-ethyl-3-phenyl-, (4S-trans)-
Alternate Name(s) 5-Ethyl-4-[(4S,5S)-4-(methoxymethyl)-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-3-phenylisoxazole [(4S,5S)-2-(5-ethyl-3-phenyl-4-isoxazolyl)-5-phenyl-4,5-dihydro-1,3-oxazol-4-yl]methyl methyl ether
CAS Registry Number 99298-95-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22N2O3
InChI InChI=1S/C22H22N2O3/c1-3-18-19(20(24-27-18)15-10-6-4-7-11-15)22-23-17(14-25-2)21(26-22)16-12-8-5-9-13-16/h4-13,17,21H,3,14H2,1-2H3/t17-,21-/m0/s1
InChIKey HTHBHLCNOCYLJX-UWJYYQICSA-N
Molecular Weight 362.429 g/mol
SMILES C1(c2c(noc2CC)-c2ccccc2)=N[C@@](COC)([C@@](O1)(c1ccccc1)[H])[H]
SPLASH splash10-014i-5209000000-fa51b2cbc0de1c2033e9
Source of Spectrum J-50-5666-10
Wiley ID 1349799