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2-Isoxazolidinepropanoic acid, 5-(methoxycarbonyl)-3-[2-(2-propenyloxy)phenyl]-, methyl ester, cis-
SpectraBase Compound ID AjlmY5kmdYr
InChI InChI=1S/C18H23NO6/c1-4-11-24-15-8-6-5-7-13(15)14-12-16(18(21)23-3)25-19(14)10-9-17(20)22-2/h4-8,14,16H,1,9-12H2,2-3H3/t14-,16+/m1/s1
InChIKey CNPJVLAJYYMGAT-ZBFHGGJFSA-N
Mol Weight 349.38 g/mol
Molecular Formula C18H23NO6
Exact Mass 349.152537 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6CdTXB1bc0F
Name 2-Isoxazolidinepropanoic acid, 5-(methoxycarbonyl)-3-[2-(2-propenyloxy)phenyl]-, methyl ester, cis-
Alternate Name(s) 2-(2-Methoxycarbonylethyl)-3-(o-allyloxyphenyl)-5-methoxycarbonylisoxazolidine Methyl (3R,5S)-3-[2-(allyloxy)phenyl]-2-(3-methoxy-3-oxopropyl)-5-isoxazolidinecarboxylate
CAS Registry Number 89903-29-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23NO6
InChI InChI=1S/C18H23NO6/c1-4-11-24-15-8-6-5-7-13(15)14-12-16(18(21)23-3)25-19(14)10-9-17(20)22-2/h4-8,14,16H,1,9-12H2,2-3H3/t14-,16+/m1/s1
InChIKey CNPJVLAJYYMGAT-ZBFHGGJFSA-N
Molecular Weight 349.383 g/mol
SMILES [C@@]1(N(O[C@@](C1)(C(=O)OC)[H])CCC(=O)OC)(c1c(OCC=C)cccc1)[H]
SPLASH splash10-002b-0946000000-986abd6f5ca2a7f82040
Source of Spectrum KC-1984-55-0
Wiley ID 1341327