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2-[N,N'-bis(1",1"-Dimethylethoxycarbonyl)hydrazino-N-(2"-hydroxy-1"-methyl-2"-phenylethyl)-N-methyl-2-(3',4'-methylenedioxyphenyl)acetamide
SpectraBase Compound ID 9JwAFeIwHNc
InChI InChI=1S/C29H39N3O8/c1-18(24(33)19-12-10-9-11-13-19)31(8)25(34)23(20-14-15-21-22(16-20)38-17-37-21)32(27(36)40-29(5,6)7)30-26(35)39-28(2,3)4/h9-16,18,23-24,33H,17H2,1-8H3,(H,30,35)/t18-,23-,24?/m0/s1
InChIKey RILUAFBNKVXAJK-VHXBAKGZSA-N
Mol Weight 557.6 g/mol
Molecular Formula C29H39N3O8
Exact Mass 557.273715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JahadbCyIFb
Name 2-[N,N'-bis(1",1"-Dimethylethoxycarbonyl)hydrazino-N-(2"-hydroxy-1"-methyl-2"-phenylethyl)-N-methyl-2-(3',4'-methylenedioxyphenyl)acetamide
Comments Less than 3 mono-isotopic peaks
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Formula C29H39N3O8
InChI InChI=1S/C29H39N3O8/c1-18(24(33)19-12-10-9-11-13-19)31(8)25(34)23(20-14-15-21-22(16-20)38-17-37-21)32(27(36)40-29(5,6)7)30-26(35)39-28(2,3)4/h9-16,18,23-24,33H,17H2,1-8H3,(H,30,35)/t18-,23-,24?/m0/s1
InChIKey RILUAFBNKVXAJK-VHXBAKGZSA-N
Molecular Weight 557.644 g/mol
SMILES N(C(OC(C)(C)C)=O)N([C@](C(N([C@](C(c1ccccc1)O)(C)[H])C)=O)(c1cc2c(OCO2)cc1)[H])C(OC(C)(C)C)=O
SPLASH splash10-000i-0090000000-59aed2a87b7bd12717c8
Source of Spectrum K1-2001-4346-2
Synonyms 2-[N,N'-bis(1'',1''-Dimethylethoxycarbonyl)hydrazino-N-(2''-hydroxy-1''-methyl-2''-phenylethyl)-N-methyl-2-(3',4'-methylenedioxyphenyl)acetamide
Wiley ID 813706