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5-METHYL-3-PHENYL-4-ISOXAZOLEGLYOXYLALDEHYDE, HYDRATE

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5-METHYL-3-PHENYL-4-ISOXAZOLEGLYOXYLALDEHYDE, HYDRATE
SpectraBase Compound ID KtergS9Zvvv
InChI InChI=1S/C12H9NO3.H2O/c1-8-11(10(15)7-14)12(13-16-8)9-5-3-2-4-6-9;/h2-7H,1H3;1H2
InChIKey XFFJBIBDANFZIS-UHFFFAOYSA-N
Mol Weight 233.22 g/mol
Molecular Formula C12H11NO4
Exact Mass 233.068808 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 2pDsucyhZwF
Name 5-METHYL-3-PHENYL-4-ISOXAZOLEGLYOXYLALDEHYDE, HYDRATE
Source of Sample M. Giannella, University of Camerino, Camerino, Italy
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11NO4
InChI InChI=1S/C12H9NO3.H2O/c1-8-11(10(15)7-14)12(13-16-8)9-5-3-2-4-6-9;/h2-7H,1H3;1H2
InChIKey XFFJBIBDANFZIS-UHFFFAOYSA-N
Literature Reference Abstract-Chemical Abstracts= 66, 104945(1967)
Melting Point 87-89C
Molecular Weight 233.223007
Synonyms 4-ISOXAZOLEGLYOXYLALDEHYDE, 5-METHYL- 3-PHENYL-, HYDRATE
Technique KBr WAFER