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4-[2-Oxo-3-p-toluenesulfonyl-2,3-dihydrooxazol-4-yl]pent-4-enoic acid methyl ester
SpectraBase Compound ID 6wKkBVrfIOo
InChI InChI=1S/C16H17NO6S/c1-11-4-7-13(8-5-11)24(20,21)17-14(10-23-16(17)19)12(2)6-9-15(18)22-3/h4-5,7-8,10H,2,6,9H2,1,3H3
InChIKey HIKJUOCCNXLFBN-UHFFFAOYSA-N
Mol Weight 351.37 g/mol
Molecular Formula C16H17NO6S
Exact Mass 351.077658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LCMZhrE0H4N
Name 4-[2-Oxo-3-p-toluenesulfonyl-2,3-dihydrooxazol-4-yl]pent-4-enoic acid methyl ester
Alternate Name(s) Methyl 4-{3-[(4-methylphenyl)sulfonyl]-2-oxo-2,3-dihydro-1,3-oxazol-4-yl}-4-pentenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17NO6S
InChI InChI=1S/C16H17NO6S/c1-11-4-7-13(8-5-11)24(20,21)17-14(10-23-16(17)19)12(2)6-9-15(18)22-3/h4-5,7-8,10H,2,6,9H2,1,3H3
InChIKey HIKJUOCCNXLFBN-UHFFFAOYSA-N
Molecular Weight 351.373 g/mol
SMILES C(CCC(=C)C=1N(C(OC1)=O)S(=O)(=O)c1ccc(cc1)C)(=O)OC
SPLASH splash10-03dj-0902000000-2241197f5e157216b7d0
Source of Spectrum QF-9-2434-0
Wiley ID 1558475