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(2S,3R)-2-(carbomethoxyamino)-3-(4-methoxyphenyl)adipic acid O6-tert-butyl ester O1-methyl ester
SpectraBase Compound ID JbCKSoHitJD
InChI InChI=1S/C20H29NO7/c1-20(2,3)28-16(22)12-11-15(13-7-9-14(25-4)10-8-13)17(18(23)26-5)21-19(24)27-6/h7-10,15,17H,11-12H2,1-6H3,(H,21,24)/t15-,17+/m1/s1
InChIKey JQGNMVXPVRVSHP-WBVHZDCISA-N
Mol Weight 395.45 g/mol
Molecular Formula C20H29NO7
Exact Mass 395.194402 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Tng7qxSDo9
Name (2S,3R)-2-(carbomethoxyamino)-3-(4-methoxyphenyl)adipic acid O6-tert-butyl ester O1-methyl ester
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Formula C20H29NO7
InChI InChI=1S/C20H29NO7/c1-20(2,3)28-16(22)12-11-15(13-7-9-14(25-4)10-8-13)17(18(23)26-5)21-19(24)27-6/h7-10,15,17H,11-12H2,1-6H3,(H,21,24)/t15-,17+/m1/s1
InChIKey JQGNMVXPVRVSHP-WBVHZDCISA-N
Molecular Weight 395.452 g/mol
SMILES N(C(=O)OC)[C@@]([C@](CCC(OC(C)(C)C)=O)(c1ccc(cc1)OC)[H])(C(=O)OC)[H]
SPLASH splash10-0006-0901000000-bf12b12dc200e000a06a
Source of Spectrum F-68-6683-10
Synonyms (2S,3R)-2-(methoxycarbonylamino)-3-(4-methoxyphenyl)hexanedioic acid O6-tert-butyl ester O1-methyl ester 6-O-tert-butyl 1-O-methyl (2S,3R)-2-(methoxycarbonylamino)-3-(4-methoxyphenyl)hexanedioate O6-tert-butyl O1-methyl (2S,3R)-2-(methoxycarbonylamino)-3-(4-methoxyphenyl)hexanedioate
Wiley ID 1573318