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(+-)-2,3,3a,4,5,6,7,7a-Octahydro-1,3-bis[(2,4,6-trimethylphenyl)methyl]-1H-1,3,2-benzodiazaphosphole-2-oxide
SpectraBase Compound ID 791NNFWd2ZA
InChI InChI=1S/C26H37N2OP/c1-17-11-19(3)23(20(4)12-17)15-27-25-9-7-8-10-26(25)28(30(27)29)16-24-21(5)13-18(2)14-22(24)6/h11-14,25-26,30H,7-10,15-16H2,1-6H3/t25-,26-/m1/s1
InChIKey MHJXFOMCDHFYCO-CLJLJLNGSA-N
Mol Weight 424.6 g/mol
Molecular Formula C26H37N2OP
Exact Mass 424.264351 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KKHNwD9JVJa
Name (+-)-2,3,3a,4,5,6,7,7a-Octahydro-1,3-bis[(2,4,6-trimethylphenyl)methyl]-1H-1,3,2-benzodiazaphosphole-2-oxide
Alternate Name(s) (+-)-2,3,3a,4,5,6,7,7a-Octahydro-1,3-bis[(2,4,6-trimethylphenyl)methyl]-1H-1,3,2-benzodiazaphosphole-2-oxtde (3aR,7aR)-1,3-bis(mesitylmethyl)octahydro-1H-1,3,2-benzodiazaphosphole 2-oxide
Comments Less than 3 mono-isotopic peaks
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Formula C26H37N2OP
InChI InChI=1S/C26H37N2OP/c1-17-11-19(3)23(20(4)12-17)15-27-25-9-7-8-10-26(25)28(30(27)29)16-24-21(5)13-18(2)14-22(24)6/h11-14,25-26,30H,7-10,15-16H2,1-6H3/t25-,26-/m1/s1
InChIKey MHJXFOMCDHFYCO-CLJLJLNGSA-N
Molecular Weight 424.569 g/mol
SMILES P1(N([C@@]2(CCCC[C@]2(N1Cc1c(cc(cc1C)C)C)[H])[H])Cc1c(cc(cc1C)C)C)=O
SPLASH splash10-001i-0900000000-ce84551215f4ee51ced6
Source of Spectrum F-54-11521-4
Wiley ID 808456