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1-Pyrrolidinebutanoic acid, 2-[(1,1-dimethylethoxy)carbonyl]-.alpha.-nitro-, 2,6-bis(1,1-dimethylethyl)-4-methoxyphenyl ester, [S-(R*,R*)]-
SpectraBase Compound ID H65sE0KsBmh
InChI InChI=1S/C28H44N2O7/c1-26(2,3)19-16-18(35-10)17-20(27(4,5)6)23(19)36-24(31)22(30(33)34)13-15-29-14-11-12-21(29)25(32)37-28(7,8)9/h16-17,21-22H,11-15H2,1-10H3
InChIKey WRYRPAPYOPZECY-UHFFFAOYSA-N
Mol Weight 520.7 g/mol
Molecular Formula C28H44N2O7
Exact Mass 520.314852 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JK4MQ43mKsy
Name 1-PYRROLIDINEBUTANOIC ACID, 2-[(1,1-DIMETHYLETHOXY)CARBONYL]-alpha-NITRO-, 2,6-BIS(1,1-DIMETHYLETHYL)-4-METHOXYPHENYL ESTER, [S-(R
Alternate Name(s) 1-PYRROLIDINEBUTANOIC ACID, 2-[(1,1-DIMETHYLETHOXY)CARBONYL]-alpha-NITRO-, 2,6-BIS(1,1-DIMETHYLETHYL)-4-METHOXYPHENYL ESTER, [S-(R*,R*)]-
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Formula C28H44N2O7
InChI InChI=1S/C28H44N2O7/c1-26(2,3)19-16-18(35-10)17-20(27(4,5)6)23(19)36-24(31)22(30(33)34)13-15-29-14-11-12-21(29)25(32)37-28(7,8)9/h16-17,21-22H,11-15H2,1-10H3
InChIKey WRYRPAPYOPZECY-UHFFFAOYSA-N
Molecular Weight 520.3137
SMILES C1N(CCC(C(=O)Oc2c(C(C)(C)C)cc(OC)cc2C(C)(C)C)N(=O)=O)C(C(OC(C)(C)C)=O)CC1
SPLASH splash10-014r-9700400000-e45e81498998f5739f93
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany