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Diethyl ((5,7-di-tert-butyl-2-mercapto-2,3-dihydrobenzo[d]oxazol-2-yl)(phenyl)methyl)-phosphonate
SpectraBase Compound ID A3oB4IoBg1
InChI InChI=1S/C26H38NO4PS/c1-9-29-32(28,30-10-2)23(18-14-12-11-13-15-18)26(33)27-21-17-19(24(3,4)5)16-20(22(21)31-26)25(6,7)8/h11-17,23,27,33H,9-10H2,1-8H3
InChIKey STFUFTWIXAZJCI-UHFFFAOYSA-N
Mol Weight 491.6 g/mol
Molecular Formula C26H38NO4PS
Exact Mass 491.225917 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AKfXZZclnUh
Name Diethyl ((5,7-di-tert-butyl-2-mercapto-2,3-dihydrobenzo[d]oxazol-2-yl)(phenyl)methyl)-phosphonate
Appearance White substance
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Formula C26H38NO4PS
InChI InChI=1S/C26H38NO4PS/c1-9-29-32(28,30-10-2)23(18-14-12-11-13-15-18)26(33)27-21-17-19(24(3,4)5)16-20(22(21)31-26)25(6,7)8/h11-17,23,27,33H,9-10H2,1-8H3
InChIKey STFUFTWIXAZJCI-UHFFFAOYSA-N
Instrument Name MS-50 Kratos
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2655
Molecular Weight 491.627 g/mol
SMILES N1C(Oc2c1cc(C(C)(C)C)cc2C(C)(C)C)(S)C(P(OCC)(OCC)=O)c1ccccc1
SPLASH splash10-0udr-0509100000-494cf21947eb03007c01
Source of Spectrum Y-54-930-3h
Wiley ID 1877992