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(phenylmethyl) N-[2-[2-(2-hydroxyethyl)-5,5-dimethyl-1,3-dioxan-2-yl]ethyl]-N-[(1R)-1-phenylethyl]carbamate
SpectraBase Compound ID KtBf6IaBxEk
InChI InChI=1S/C26H35NO5/c1-21(23-12-8-5-9-13-23)27(24(29)30-18-22-10-6-4-7-11-22)16-14-26(15-17-28)31-19-25(2,3)20-32-26/h4-13,21,28H,14-20H2,1-3H3/t21-/m1/s1
InChIKey BYXYNGOMTDIHNR-OAQYLSRUSA-N
Mol Weight 441.6 g/mol
Molecular Formula C26H35NO5
Exact Mass 441.251523 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HzbmNLwMcJp
Name (phenylmethyl) N-[2-[2-(2-hydroxyethyl)-5,5-dimethyl-1,3-dioxan-2-yl]ethyl]-N-[(1R)-1-phenylethyl]carbamate
Alternate Name(s) benzyl N-[2-[2-(2-hydroxyethyl)-5,5-dimethyl-1,3-dioxan-2-yl]ethyl]-N-[(1R)-1-phenylethyl]carbamate N-[2-[2-(2-hydroxyethyl)-5,5-dimethyl-1,3-dioxan-2-yl]ethyl]-N-[(1R)-1-phenylethyl]carbamic acid (phenylmethyl) ester N-[2-[2-(2-hydroxyethyl)-5,5-dimethyl-1,3-dioxan-2-yl]ethyl]-N-[(1R)-1-phenylethyl]carbamic acid benzyl ester
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Formula C26H35NO5
InChI InChI=1S/C26H35NO5/c1-21(23-12-8-5-9-13-23)27(24(29)30-18-22-10-6-4-7-11-22)16-14-26(15-17-28)31-19-25(2,3)20-32-26/h4-13,21,28H,14-20H2,1-3H3/t21-/m1/s1
InChIKey BYXYNGOMTDIHNR-OAQYLSRUSA-N
Molecular Weight 441.568 g/mol
SMILES OCCC1(CCN(C(OCc2ccccc2)=O)[C@@](c2ccccc2)(C)[H])OCC(CO1)(C)C
SPLASH splash10-0a4i-3900000000-f454bc1e5f8bccb14e72
Source of Spectrum K1-2004-5132-13
Wiley ID 1562044