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(4S,5S)-4-(methoxymethyl)-5-(4-methylsulfonylphenyl)-2-phenyl-4,5-dihydrooxazole
SpectraBase Compound ID B94vrMQU3Px
InChI InChI=1S/C18H19NO4S/c1-22-12-16-17(13-8-10-15(11-9-13)24(2,20)21)23-18(19-16)14-6-4-3-5-7-14/h3-11,16-17H,12H2,1-2H3/t16-,17-/m0/s1
InChIKey BKAFLEWELLBRBC-IRXDYDNUSA-N
Mol Weight 345.41 g/mol
Molecular Formula C18H19NO4S
Exact Mass 345.103479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IEhoCjdvU1o
Name (4S,5S)-4-(methoxymethyl)-5-(4-methylsulfonylphenyl)-2-phenyl-4,5-dihydrooxazole
Alternate Name(s) (4S,5S)-5-(4-mesylphenyl)-4-(methoxymethyl)-2-phenyl-2-oxazoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19NO4S
InChI InChI=1S/C18H19NO4S/c1-22-12-16-17(13-8-10-15(11-9-13)24(2,20)21)23-18(19-16)14-6-4-3-5-7-14/h3-11,16-17H,12H2,1-2H3/t16-,17-/m0/s1
InChIKey BKAFLEWELLBRBC-IRXDYDNUSA-N
Molecular Weight 345.413 g/mol
SMILES C=1(O[C@]([C@@](N1)(COC)[H])(c1ccc(cc1)S(=O)(=O)C)[H])c1ccccc1
SPLASH splash10-0udi-3908000000-006544a74c7d1cadabb8
Source of Spectrum KD-16-957-16
Wiley ID 1637545