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(3R*,5S*,6R*)-3-Isopropyl-5-mesitylamino-6-methyl-6-phenyl-1,2,4-trioxane
SpectraBase Compound ID Jj5UMMMmzVN
InChI InChI=1S/C22H29NO3/c1-14(2)20-24-21(23-19-16(4)12-15(3)13-17(19)5)22(6,26-25-20)18-10-8-7-9-11-18/h7-14,20-21,23H,1-6H3/t20-,21+,22-/m1/s1
InChIKey NRPZRBDIEDOEEX-BHIFYINESA-N
Mol Weight 355.48 g/mol
Molecular Formula C22H29NO3
Exact Mass 355.214744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ZEBqkBzWdL
Name (3R*,5S*,6R*)-3-Isopropyl-5-mesitylamino-6-methyl-6-phenyl-1,2,4-trioxane
Comments Less than 3 mono-isotopic peaks
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Formula C22H29NO3
InChI InChI=1S/C22H29NO3/c1-14(2)20-24-21(23-19-16(4)12-15(3)13-17(19)5)22(6,26-25-20)18-10-8-7-9-11-18/h7-14,20-21,23H,1-6H3/t20-,21+,22-/m1/s1
InChIKey NRPZRBDIEDOEEX-BHIFYINESA-N
Molecular Weight 355.478 g/mol
SMILES N([C@@]1([C@](OO[C@@](O1)(C(C)C)[H])(c1ccccc1)C)[H])c1c(cc(cc1C)C)C
SPLASH splash10-03di-0900000000-69204d54df87075c31ec
Source of Spectrum AJ-62-4052-7
Synonyms (3R,5S,6R)-3-isopropyl-N-mesityl-6-methyl-6-phenyl-1,2,4-trioxan-5-amine N-[(3R,5S,6R)-3-isopropyl-6-methyl-6-phenyl-1,2,4-trioxan-5-yl]-N-mesitylamine
Wiley ID 1345379