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Diethyl 1-enzoyl-1-phenylhept-2-yne-1-phosphate
SpectraBase Compound ID 9ix9KKnyosr
InChI InChI=1S/C24H29O5P/c1-6-27-30(26,28-7-2)29-24(19-18-23(3,4)5,21-16-12-9-13-17-21)22(25)20-14-10-8-11-15-20/h8-17H,6-7H2,1-5H3
InChIKey KDXVJBANEFUPDG-UHFFFAOYSA-N
Mol Weight 428.46 g/mol
Molecular Formula C24H29O5P
Exact Mass 428.175261 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GJTQfG58QAQ
Name Diethyl 1-enzoyl-1-phenylhept-2-yne-1-phosphate
Alternate Name(s) phosphoric acid (5,5-dimethyl-1-oxo-1,2-diphenylhex-3-yn-2-yl) diethyl ester (5,5-dimethyl-1-oxo-1,2-diphenylhex-3-yn-2-yl) diethyl phosphate (1-benzoyl-4,4-dimethyl-1-phenyl-pent-2-ynyl) diethyl phosphate (5,5-dimethyl-1-oxidanylidene-1,2-diphenyl-hex-3-yn-2-yl) diethyl phosphate
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Formula C24H29O5P
InChI InChI=1S/C24H29O5P/c1-6-27-30(26,28-7-2)29-24(19-18-23(3,4)5,21-16-12-9-13-17-21)22(25)20-14-10-8-11-15-20/h8-17H,6-7H2,1-5H3
InChIKey KDXVJBANEFUPDG-UHFFFAOYSA-N
Molecular Weight 428.465 g/mol
SMILES C(C#CC(C)(C)C)(C(=O)c1ccccc1)(OP(=O)(OCC)OCC)c1ccccc1
SPLASH splash10-0a4i-0900100000-d2b725ea1e9cea9f88e7
Source of Spectrum C-129-9877-41
Wiley ID 1701876