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Diethyl (1E,6E)-2-butyl-5-hydroxy-7-phenylhepta-1,6-dienylphosphonate
SpectraBase Compound ID lP7QOaBmfH
InChI InChI=1S/C21H33O4P/c1-5-17(4)25-26(23,24)21(7-3)19(6-2)14-16-20(22)15-13-18-11-9-8-10-12-18/h8-13,15,17,20,22H,5-7,14,16H2,1-4H3,(H,23,24)/b15-13+,21-19+
InChIKey ZGIFVYCGLKHVER-ORGNSXLLSA-N
Mol Weight 380.5 g/mol
Molecular Formula C21H33O4P
Exact Mass 380.211647 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5k1Palsmfuz
Name Diethyl (1E,6E)-2-butyl-5-hydroxy-7-phenylhepta-1,6-dienylphosphonate
Alternate Name(s) sec-butyl hydrogen (1E,6E)-1,2-diethyl-5-hydroxy-7-phenyl-1,6-heptadienylphosphonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H33O4P
InChI InChI=1S/C21H33O4P/c1-5-17(4)25-26(23,24)21(7-3)19(6-2)14-16-20(22)15-13-18-11-9-8-10-12-18/h8-13,15,17,20,22H,5-7,14,16H2,1-4H3,(H,23,24)/b15-13+,21-19+
InChIKey ZGIFVYCGLKHVER-ORGNSXLLSA-N
Molecular Weight 380.465 g/mol
SMILES OC(CC\C(=C/(P(OC(CC)C)(=O)O)CC)CC)\C=C\c1ccccc1
SPLASH splash10-0573-9260000000-5a13183750f2db9ec1ce
Source of Spectrum F-62-5997-5
Wiley ID 1633764