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rel-(3S,5S)-2-(Alloxycarbonyl)-1-benzyl-5-(formmethyl)-5-methylhexahydro-3-pyridazinecarboxylic acid methyl ester
SpectraBase Compound ID EDgKwZAxJRZ
InChI InChI=1S/C19H24N2O6/c1-4-10-26-18(24)21-16(17(23)25-3)11-19(2,27-14-22)13-20(21)12-15-8-6-5-7-9-15/h4-9,14,16H,1,10-13H2,2-3H3/t16-,19-/m0/s1
InChIKey URNBXXYGEJSSMB-LPHOPBHVSA-N
Mol Weight 376.41 g/mol
Molecular Formula C19H24N2O6
Exact Mass 376.163436 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Y1NoePMySC
Name rel-(3S,5S)-2-(Alloxycarbonyl)-1-benzyl-5-(formmethyl)-5-methylhexahydro-3-pyridazinecarboxylic acid methyl ester
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Formula C19H24N2O6
InChI InChI=1S/C19H24N2O6/c1-4-10-26-18(24)21-16(17(23)25-3)11-19(2,27-14-22)13-20(21)12-15-8-6-5-7-9-15/h4-9,14,16H,1,10-13H2,2-3H3/t16-,19-/m0/s1
InChIKey URNBXXYGEJSSMB-LPHOPBHVSA-N
Molecular Weight 376.409 g/mol
SMILES [C@]1(N(N(C[C@](C1)(OC=O)C)Cc1ccccc1)C(=O)OCC=C)(C(=O)OC)[H]
SPLASH splash10-0006-9036000000-1962da08c1173a83da9e
Source of Spectrum F-49-8620-38
Synonyms 1-Allyl 6-methyl (4S,6S)-2-benzyl-4-(formyloxy)-4-methyltetrahydro-1,6(2H)-pyridazinedicarboxylate rel-(3S,5S)-2-(Alloxycarbonyl)-1-benzyl-5-(formyloxy)-5-methylhexahydro-3-pyridazinecarboxylic acid methyl ester
Wiley ID 788305