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Phosphorin, 2,6-bis(1,1-dimethylethyl)-1,2-dihydro-1-methoxy-4-(4-methoxyphenyl)- , 1-oxide, cis-
SpectraBase Compound ID 63a1aGyXI7p
InChI InChI=1S/C21H31O3P/c1-20(2,3)18-13-16(15-9-11-17(23-7)12-10-15)14-19(21(4,5)6)25(18,22)24-8/h9-14,18H,1-8H3/t18-,25+/m0/s1
InChIKey FCXYZOWWOSAAGR-AVRWGWEMSA-N
Mol Weight 362.45 g/mol
Molecular Formula C21H31O3P
Exact Mass 362.201082 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F7VXK6SwR2F
Name Phosphorin, 2,6-bis(1,1-dimethylethyl)-1,2-dihydro-1-methoxy-4-(4-methoxyphenyl)- , 1-oxide, cis-
CAS Registry Number 62496-94-0
Comments Less than 3 mono-isotopic peaks
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Formula C21H31O3P
InChI InChI=1S/C21H31O3P/c1-20(2,3)18-13-16(15-9-11-17(23-7)12-10-15)14-19(21(4,5)6)25(18,22)24-8/h9-14,18H,1-8H3/t18-,25+/m0/s1
InChIKey FCXYZOWWOSAAGR-AVRWGWEMSA-N
Molecular Weight 362.450 g/mol
SMILES C=1([P@]([C@@](C=C(C1)c1ccc(cc1)OC)(C(C)(C)C)[H])(=O)OC)C(C)(C)C
SPLASH splash10-0a4i-0009000000-406489890f9597448e7f
Source of Spectrum K-110-408-0
Synonyms (2S)-2,6-ditert-butyl-1-methoxy-4-(4-methoxyphenyl)-1,2-dihydrophosphorin 1-oxide (Z)-2,6-Di-t-butyl-1-methoxy-4-(4-methoxyphenyl)-1-oxo-1.lambda.*5-phospha-2,4-cyclohexadiene 4-[(2S)-2,6-ditert-butyl-1-methoxy-1-oxido-1,2-dihydro-4-phosphorinyl]phenyl methyl ether
Wiley ID 1349758