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Phosphonic acid, [(5-cyano-4,5-dihydro-3-isoxazolyl)methyl]-, diethyl ester
SpectraBase Compound ID 7ThGP9oyQkf
InChI InChI=1S/C9H15N2O4P/c1-3-13-16(12,14-4-2)7-8-5-9(6-10)15-11-8/h9H,3-5,7H2,1-2H3
InChIKey WLKHDGZEASFNGE-UHFFFAOYSA-N
Mol Weight 246.2 g/mol
Molecular Formula C9H15N2O4P
Exact Mass 246.076944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4KSNIivRpV
Name Phosphonic acid, [(5-cyano-4,5-dihydro-3-isoxazolyl)methyl]-, diethyl ester
Alternate Name(s) 3-[(diethoxyphosphoryl)methyl]-5-cyano-2-isoxazoline Diethyl (5-cyano-4,5-dihydro-3-isoxazolyl)methylphosphonate
CAS Registry Number 107487-04-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H15N2O4P
InChI InChI=1S/C9H15N2O4P/c1-3-13-16(12,14-4-2)7-8-5-9(6-10)15-11-8/h9H,3-5,7H2,1-2H3
InChIKey WLKHDGZEASFNGE-UHFFFAOYSA-N
Molecular Weight 246.203 g/mol
SMILES C(P(=O)(OCC)OCC)C1=NOC(C#N)C1
SPLASH splash10-001j-9620000000-f1df6a7e540b6f8b6c45
Source of Spectrum AJ-60-2468-7
Wiley ID 1248421