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3-Mesityl-5-(phenylsulfonyl)isoxazoline
SpectraBase Compound ID 9JvrYBOEOQi
InChI InChI=1S/C18H19NO3S/c1-12-9-13(2)18(14(3)10-12)16-11-17(22-19-16)23(20,21)15-7-5-4-6-8-15/h4-10,17H,11H2,1-3H3
InChIKey OPBVUFZPJKEMGK-UHFFFAOYSA-N
Mol Weight 329.41 g/mol
Molecular Formula C18H19NO3S
Exact Mass 329.108565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3nfnsWslWq
Name 3-Mesityl-5-(phenylsulfonyl)isoxazoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19NO3S
InChI InChI=1S/C18H19NO3S/c1-12-9-13(2)18(14(3)10-12)16-11-17(22-19-16)23(20,21)15-7-5-4-6-8-15/h4-10,17H,11H2,1-3H3
InChIKey OPBVUFZPJKEMGK-UHFFFAOYSA-N
Molecular Weight 329.414 g/mol
SMILES C1(=NOC(C1)S(=O)(=O)c1ccccc1)c1c(C)cc(C)cc1C
SPLASH splash10-002r-0907000000-4a01799b073cc09c3f2c
Source of Spectrum AN-106-682-8
Synonyms 3-Mesityl-4,5-dihydro-5-isoxazolyl phenyl sulfone 3-Mesityl-5-(phenylsulfonyl)-4,5-dihydroisoxazole
Wiley ID 747687