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2-[N,N'-bis(1",1"-Dimethylethoxycarbonyl)hydrazino-N-(2"-hydroxy-1"-methyl-2"-phenylethyl)-N-methyl-2-(3',4',5'-trimethoxyphenyl)acetamide

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2-[N,N'-bis(1",1"-Dimethylethoxycarbonyl)hydrazino-N-(2"-hydroxy-1"-methyl-2"-phenylethyl)-N-methyl-2-(3',4',5'-trimethoxyphenyl)acetamide
SpectraBase Compound ID AfoHJ2gkmTH
InChI InChI=1S/C31H45N3O9/c1-19(25(35)20-15-13-12-14-16-20)33(8)27(36)24(21-17-22(39-9)26(41-11)23(18-21)40-10)34(29(38)43-31(5,6)7)32-28(37)42-30(2,3)4/h12-19,24-25,35H,1-11H3,(H,32,37)/t19-,24-,25?/m0/s1
InChIKey RCRBMGTTWOLCSU-XIJCICFPSA-N
Mol Weight 603.7 g/mol
Molecular Formula C31H45N3O9
Exact Mass 603.31558 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 54QYhRp9lYb
Name 2-[N,N'-bis(1",1"-Dimethylethoxycarbonyl)hydrazino-N-(2"-hydroxy-1"-methyl-2"-phenylethyl)-N-methyl-2-(3',4',5'-trimethoxyphenyl)acetamide
Comments Removed - expert review: contamination (acetone))
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H45N3O9
InChI InChI=1S/C31H45N3O9/c1-19(25(35)20-15-13-12-14-16-20)33(8)27(36)24(21-17-22(39-9)26(41-11)23(18-21)40-10)34(29(38)43-31(5,6)7)32-28(37)42-30(2,3)4/h12-19,24-25,35H,1-11H3,(H,32,37)/t19-,24-,25?/m0/s1
InChIKey RCRBMGTTWOLCSU-XIJCICFPSA-N
Molecular Weight 603.713 g/mol
SMILES N(C(OC(C)(C)C)=O)N([C@](C(N([C@](C(c1ccccc1)O)(C)[H])C)=O)(c1cc(OC)c(c(c1)OC)OC)[H])C(OC(C)(C)C)=O
SPLASH splash10-0a4i-9000000000-5f9b39b7151656e5a9ac
Source of Spectrum K1-2001-4347-2
Synonyms 2-[N,N'-bis(1'',1''-Dimethylethoxycarbonyl)hydrazino-N-(2''-hydroxy-1''-methyl-2''-phenylethyl)-N-methyl-2-(3',4',5'-trimethoxyphenyl)acetamide
Wiley ID 813705