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N-(N-benzyloxycarbonyl-L-prolyl)-L-homoserine lactone
SpectraBase Compound ID H6GYOGukrZS
InChI InChI=1S/C17H20N2O5/c20-15(18-13-8-10-23-16(13)21)14-7-4-9-19(14)17(22)24-11-12-5-2-1-3-6-12/h1-3,5-6,13-14H,4,7-11H2,(H,18,20)/t13-,14-/m0/s1
InChIKey YGKKRTLGUHIBNV-KBPBESRZSA-N
Mol Weight 332.36 g/mol
Molecular Formula C17H20N2O5
Exact Mass 332.137222 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 74x7aRHDXUs
Name N-(N-benzyloxycarbonyl-L-prolyl)-L-homoserine lactone
Appearance Yellowish foamy solid
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Formula C17H20N2O5
InChI InChI=1S/C17H20N2O5/c20-15(18-13-8-10-23-16(13)21)14-7-4-9-19(14)17(22)24-11-12-5-2-1-3-6-12/h1-3,5-6,13-14H,4,7-11H2,(H,18,20)/t13-,14-/m0/s1
InChIKey YGKKRTLGUHIBNV-KBPBESRZSA-N
Ionization Type EI
Molecular Weight 332.356 g/mol
Optical Rotation [a]D = -68.75 (c = 0.2, CHCl3)
Reported Formula C17H20N2O5
SMILES N(C([C@]1(N(CCC1)C(=O)OCc1ccccc1)[H])=O)[C@@]1(C(OCC1)=O)[H]
SPLASH splash10-0006-9010000000-1e9a80e83ec525761c44
Source of Spectrum WO2014125145A1
Wiley ID 1850061