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Phosphonic acid, (6-methyl-2-phenyl-4-pyrimidinyl)-, bis(1-methylethyl) ester
SpectraBase Compound ID CpdaSqthYKp
InChI InChI=1S/C17H23N2O3P/c1-12(2)21-23(20,22-13(3)4)16-11-14(5)18-17(19-16)15-9-7-6-8-10-15/h6-13H,1-5H3
InChIKey DTEFXLDLKJOHRR-UHFFFAOYSA-N
Mol Weight 334.36 g/mol
Molecular Formula C17H23N2O3P
Exact Mass 334.14463 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LAStmMIObms
Name Phosphonic acid, (6-methyl-2-phenyl-4-pyrimidinyl)-, bis(1-methylethyl) ester
Alternate Name(s) diisopropyl 6-methyl-2-phenyl-4-pyrimidinylphosphonate
CAS Registry Number 102969-45-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H23N2O3P
InChI InChI=1S/C17H23N2O3P/c1-12(2)21-23(20,22-13(3)4)16-11-14(5)18-17(19-16)15-9-7-6-8-10-15/h6-13H,1-5H3
InChIKey DTEFXLDLKJOHRR-UHFFFAOYSA-N
Molecular Weight 334.356 g/mol
SMILES c1(P(OC(C)C)(OC(C)C)=O)nc(-c2ccccc2)nc(c1)C
SPLASH splash10-00e9-0791000000-24acced37b98ec0a3915
Source of Spectrum AH-116-1046-6
Wiley ID 1330839