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trans-3-carbethoxy-5-methyl-4-phenyl-2-isoxazoline
SpectraBase Compound ID DwMVs3cS2jo
InChI InChI=1S/C13H15NO3/c1-3-16-13(15)12-11(9(2)17-14-12)10-7-5-4-6-8-10/h4-9,11H,3H2,1-2H3/t9-,11+/m1/s1
InChIKey UJRSFXKDRIBPJG-KOLCDFICSA-N
Mol Weight 233.27 g/mol
Molecular Formula C13H15NO3
Exact Mass 233.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HDx60LBpsnO
Name trans-3-carbethoxy-5-methyl-4-phenyl-2-isoxazoline
Alternate Name(s) Ethyl (4S,5R)-5-methyl-4-phenyl-4,5-dihydro-3-isoxazolecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO3
InChI InChI=1S/C13H15NO3/c1-3-16-13(15)12-11(9(2)17-14-12)10-7-5-4-6-8-10/h4-9,11H,3H2,1-2H3/t9-,11+/m1/s1
InChIKey UJRSFXKDRIBPJG-KOLCDFICSA-N
Molecular Weight 233.267 g/mol
SMILES C1(=NO[C@@]([C@]1(c1ccccc1)[H])(C)[H])C(=O)OCC
SPLASH splash10-014i-0900000000-fca50bb3dcaa625208ec
Source of Spectrum O-29-232-0
Wiley ID 1234943