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(2S,3S,4S)-2-[2'-((S)-4''-Benzyl-2''-oxo-oxazolidin-3''-yl)-2-oxo-ethyl]-N-cyclohexyl-5-cyano-3,4-dimethyl-piperidine

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(2S,3S,4S)-2-[2'-((S)-4''-Benzyl-2''-oxo-oxazolidin-3''-yl)-2-oxo-ethyl]-N-cyclohexyl-5-cyano-3,4-dimethyl-piperidine
SpectraBase Compound ID Jp1rA9EOVVL
InChI InChI=1S/C26H35N3O3/c1-18-13-22(16-27)28(21-11-7-4-8-12-21)24(19(18)2)15-25(30)29-23(17-32-26(29)31)14-20-9-5-3-6-10-20/h3,5-6,9-10,18-19,21-24H,4,7-8,11-15,17H2,1-2H3/t18-,19+,22?,23+,24+/m1/s1
InChIKey ANNYOLBIUHXUTG-PGRBMBIASA-N
Mol Weight 437.6 g/mol
Molecular Formula C26H35N3O3
Exact Mass 437.267842 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 37L9W3iyumK
Name (2S,3S,4S)-2-[2'-((S)-4''-Benzyl-2''-oxo-oxazolidin-3''-yl)-2-oxo-ethyl]-N-cyclohexyl-5-cyano-3,4-dimethyl-piperidine
Alternate Name(s) (2S,3S,4S)-2-[2'-((S)-4''-Benzyl-2''-oxo-oxazolidin-3''-yl)-2-oxo-ethyl]-N-cyclohexyl-6-cyano-3,4-dimethyl-piperidine (4S,5S,6S)-6-{2-[(4S)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]-2-oxoethyl}-1-cyclohexyl-4,5-dimethyl-3-piperidinecarbonitrile 2-[2'-(2''-Oxo-5-benzyloxazol-3''-yl)-2'-oxoethyl]-N-cyclohexyl-5-cyano-3,4-dimethylpiperidine 2-[2'-(2''-Oxo-5-benzyloxazol-3''-yl)-2'-oxoethyl]-N-cyclohexyl-6-cyano-3,4-dimethylpiperidine (4R,5S,6S)-1-cyclohexyl-4,5-dimethyl-6-[2-oxo-2-[(4S)-2-oxo-4-(phenylmethyl)-3-oxazolidinyl]ethyl]-2-piperidinecarbonitrile (4R,5S,6S)-6-[2-[(4S)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]-2-oxoethyl]-1-cyclohexyl-4,5-dimethylpiperidine-2-carbonitrile (4R,5S,6S)-6-[2-[(4S)-4-benzyl-2-oxo-oxazolidin-3-yl]-2-oxo-ethyl]-1-cyclohexyl-4,5-dimethyl-piperidine-2-carbonitrile (4R,5S,6S)-1-cyclohexyl-4,5-dimethyl-6-[2-oxidanylidene-2-[(4S)-2-oxidanylidene-4-(phenylmethyl)-1,3-oxazolidin-3-yl]ethyl]piperidine-2-carbonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C26H35N3O3
InChI InChI=1S/C26H35N3O3/c1-18-13-22(16-27)28(21-11-7-4-8-12-21)24(19(18)2)15-25(30)29-23(17-32-26(29)31)14-20-9-5-3-6-10-20/h3,5-6,9-10,18-19,21-24H,4,7-8,11-15,17H2,1-2H3/t18-,19+,22?,23+,24+/m1/s1
InChIKey ANNYOLBIUHXUTG-PGRBMBIASA-N
Molecular Weight 437.584 g/mol
SMILES C(N1C(OC[C@@]1(Cc1ccccc1)[H])=O)(C[C@@]1(N(C(C#N)C[C@]([C@@]1(C)[H])(C)[H])C1CCCCC1)[H])=O
SPLASH splash10-03di-0000900000-15c9ff6c94287191a858
Source of Spectrum U1-1999-3360-13
Wiley ID 753490