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N1-Benzyl-N1,N2-bis(tert-butoxycarbonyl)pyrrolidine-1-carboxamidine
SpectraBase Compound ID 5QaI3XMzEp8
InChI InChI=1S/C22H33N3O4/c1-21(2,3)28-19(26)23-18(24-14-10-11-15-24)25(20(27)29-22(4,5)6)16-17-12-8-7-9-13-17/h7-9,12-13H,10-11,14-16H2,1-6H3/b23-18+
InChIKey PEEZCEHGCFADTH-PTGBLXJZSA-N
Mol Weight 403.5 g/mol
Molecular Formula C22H33N3O4
Exact Mass 403.247107 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2FAjgDj81Po
Name N1-Benzyl-N1,N2-bis(tert-butoxycarbonyl)pyrrolidine-1-carboxamidine
Alternate Name(s) tert-Butyl benzyl[(E)-{[(E)-tert-butoxy(oxo)methyl]imino}(1-pyrrolidinyl)methyl]carbamate N-[(E)-[(2-methylpropan-2-yl)oxy-oxomethyl]imino-(1-pyrrolidinyl)methyl]-N-(phenylmethyl)carbamic acid tert-butyl ester tert-Butyl N-benzyl-N-[(E)-N-[(2-methylpropan-2-yl)oxycarbonyl]-C-pyrrolidin-1-ylcarbonimidoyl]carbamate tert-Butyl N-benzyl-N-[(E)-N-tert-butoxycarbonyl-C-pyrrolidin-1-yl-carbonimidoyl]carbamate tert-Butyl N-[(E)-N-[(2-methylpropan-2-yl)oxycarbonyl]-C-pyrrolidin-1-yl-carbonimidoyl]-N-(phenylmethyl)carbamate
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Formula C22H33N3O4
InChI InChI=1S/C22H33N3O4/c1-21(2,3)28-19(26)23-18(24-14-10-11-15-24)25(20(27)29-22(4,5)6)16-17-12-8-7-9-13-17/h7-9,12-13H,10-11,14-16H2,1-6H3/b23-18+
InChIKey PEEZCEHGCFADTH-PTGBLXJZSA-N
Molecular Weight 403.523 g/mol
SMILES C(N(\C(=N\C(OC(C)(C)C)=O)N1CCCC1)Cc1ccccc1)(OC(C)(C)C)=O
SPLASH splash10-0ab9-9450100000-4f71cf59e9d3e6652a35
Source of Spectrum F-68-2307-5
Wiley ID 1572060