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(3S,5R,6S)-3-benzyl-4-methyl-5-phenyl-6-propan-2-ylmorpholin-2-one
SpectraBase Compound ID HT44gTJL5Va
InChI InChI=1S/C21H25NO2/c1-15(2)20-19(17-12-8-5-9-13-17)22(3)18(21(23)24-20)14-16-10-6-4-7-11-16/h4-13,15,18-20H,14H2,1-3H3/t18-,19+,20-/m0/s1
InChIKey VYUQZDNGBGMMCR-ZCNNSNEGSA-N
Mol Weight 323.44 g/mol
Molecular Formula C21H25NO2
Exact Mass 323.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4XN1vNnr91m
Name (3S,5R,6S)-3-benzyl-4-methyl-5-phenyl-6-propan-2-ylmorpholin-2-one
Alternate Name(s) (3S,5R,6S)-3-benzyl-6-isopropyl-4-methyl-5-phenyl-morpholin-2-one (3S,5R,6S)-4-methyl-5-phenyl-3-(phenylmethyl)-6-propan-2-yl-2-morpholinone (3S,5R,6S)-4-methyl-5-phenyl-3-(phenylmethyl)-6-propan-2-yl-morpholin-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C21H25NO2
InChI InChI=1S/C21H25NO2/c1-15(2)20-19(17-12-8-5-9-13-17)22(3)18(21(23)24-20)14-16-10-6-4-7-11-16/h4-13,15,18-20H,14H2,1-3H3/t18-,19+,20-/m0/s1
InChIKey VYUQZDNGBGMMCR-ZCNNSNEGSA-N
Molecular Weight 323.436 g/mol
SMILES C1(O[C@]([C@](N([C@]1(Cc1ccccc1)[H])C)(c1ccccc1)[H])(C(C)C)[H])=O
SPLASH splash10-001i-0090000000-5bd2bd703abb5dcecb5f
Source of Spectrum J-65-3039-15
Wiley ID 1532499