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5-[2-(2-acetamido-3-acetoxy-hexyl)-1,3-dioxolan-2-yl]-1H-pyrrole-2-carboxylic acid methyl ester
SpectraBase Compound ID FP60n7wJTAO
InChI InChI=1S/C19H28N2O7/c1-5-6-16(28-13(3)23)15(20-12(2)22)11-19(26-9-10-27-19)17-8-7-14(21-17)18(24)25-4/h7-8,15-16,21H,5-6,9-11H2,1-4H3,(H,20,22)
InChIKey CMUCFNMFQRCHFQ-UHFFFAOYSA-N
Mol Weight 396.44 g/mol
Molecular Formula C19H28N2O7
Exact Mass 396.189651 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JTKhnDJpLBK
Name 5-[2-(2-acetamido-3-acetoxy-hexyl)-1,3-dioxolan-2-yl]-1H-pyrrole-2-carboxylic acid methyl ester
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Formula C19H28N2O7
InChI InChI=1S/C19H28N2O7/c1-5-6-16(28-13(3)23)15(20-12(2)22)11-19(26-9-10-27-19)17-8-7-14(21-17)18(24)25-4/h7-8,15-16,21H,5-6,9-11H2,1-4H3,(H,20,22)
InChIKey CMUCFNMFQRCHFQ-UHFFFAOYSA-N
Molecular Weight 396.440 g/mol
SMILES [nH]1c(C2(CC(C(CCC)OC(=O)C)NC(C)=O)OCCO2)ccc1C(=O)OC
SPLASH splash10-0002-1900000000-e2d513e3d8f206e97ac5
Source of Spectrum E1-46-567-38
Synonyms 5-[2-(2-acetamido-3-acetyloxyhexyl)-1,3-dioxolan-2-yl]-1H-pyrrole-2-carboxylic acid methyl ester Methyl 5-[2-(2-acetamido-3-acetoxy-hexyl)-1,3-dioxolan-2-yl]-1H-pyrrole-2-carboxylate Methyl 5-[2-(2-acetamido-3-acetyloxy-hexyl)-1,3-dioxolan-2-yl]-1H-pyrrole-2-carboxylate
Wiley ID 1554329