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Spiro[cyclohexane-1,1'(2'H)-pyrrolo[3,4-c]pyrrole]-3'-carboxylic acid, hexahydro-5'-methyl-4',6'-dioxo-, methyl ester, (3'.alpha.,3'a.beta.,6'a.beta.)-
SpectraBase Compound ID 7hPHeWUBz02
InChI InChI=1S/C14H20N2O4/c1-16-11(17)8-9(12(16)18)14(6-4-3-5-7-14)15-10(8)13(19)20-2/h8-10,15H,3-7H2,1-2H3/t8-,9-,10+/m1/s1
InChIKey BUHIFHLWEHJWIL-BBBLOLIVSA-N
Mol Weight 280.32 g/mol
Molecular Formula C14H20N2O4
Exact Mass 280.142307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LMnSkp5L7dy
Name Spiro[cyclohexane-1,1'(2'H)-pyrrolo[3,4-c]pyrrole]-3'-carboxylic acid, hexahydro-5'-methyl-4',6'-dioxo-, methyl ester, (3'.alpha.,3'a.beta.,6'a.beta.)-
CAS Registry Number 111099-00-4
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20N2O4
InChI InChI=1S/C14H20N2O4/c1-16-11(17)8-9(12(16)18)14(6-4-3-5-7-14)15-10(8)13(19)20-2/h8-10,15H,3-7H2,1-2H3/t8-,9-,10+/m1/s1
InChIKey BUHIFHLWEHJWIL-BBBLOLIVSA-N
Molecular Weight 280.324 g/mol
SMILES N1[C@@]([C@]2([C@@](C11CCCCC1)(C(N(C2=O)C)=O)[H])[H])(C(=O)OC)[H]
SPLASH splash10-003i-9550000000-c80ed591eb3bc4a9d452
Source of Spectrum AJ-60-4073-21
Synonyms Methyl (3'S,3'aR,6'aS)-5'-methyl-4',6'-dioxo-hexahydro-2'H-spiro[cyclohexane-1,1'-pyrrolo[3,4-c]pyrrole]-3'-carboxylate Spiro[cyclohexane-1,6',-1',3',3a',4',6',6a'-hexahydro-4'-methoxycarbonyl-2'-methyllpyrrolo[3,4-c]pyrrol-1',3'-dione]
Wiley ID 1283655