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N-Trideuteroacetyl-(N,0-pertrideuteromethyl)-prolyl-leucyl-valyl-alanyl-propyl-alanine
SpectraBase Compound ID HKL0a9uKBF8
InChI InChI=1S/C34H58N6O8/c1-20(2)19-27(37(10)31(44)25-15-13-17-39(25)24(7)41)32(45)38(11)28(21(3)4)33(46)35(8)22(5)29(42)40-18-14-16-26(40)30(43)36(9)23(6)34(47)48-12/h20-23,25-28H,13-19H2,1-12H3/i7D3,8D3,9D3,10D3,11D3,12D3
InChIKey VZBMHBFDZBMRNG-BZBZNWFSSA-N
Mol Weight 697.0 g/mol
Molecular Formula C34H402D18N6O8
Exact Mass 696.544594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BcvU0LJHoXs
Name N-Trideuteroacetyl-(N,0-pertrideuteromethyl)-prolyl-leucyl-valyl-alanyl-propyl-alanine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H40D18N6O8
InChI InChI=1S/C34H58N6O8/c1-20(2)19-27(37(10)31(44)25-15-13-17-39(25)24(7)41)32(45)38(11)28(21(3)4)33(46)35(8)22(5)29(42)40-18-14-16-26(40)30(43)36(9)23(6)34(47)48-12/h20-23,25-28H,13-19H2,1-12H3/i7D3,8D3,9D3,10D3,11D3,12D3
InChIKey VZBMHBFDZBMRNG-BZBZNWFSSA-N
Molecular Weight 696.982 g/mol
SMILES C(N(C(C(N1C(C(N(C(C(=O)OC([2D])([2D])[2D])C)C([2D])([2D])[2D])=O)CCC1)=O)C)C([2D])([2D])[2D])(C(N(C(C(N(C(C1N(C(=O)C([2D])([2D])[2D])CCC1)=O)C([2D])([2D])[2D])CC(C)C)=O)C([2D])([2D])[2D])C(C)C)=O
SPLASH splash10-00dl-0985100000-30072a6b37a78688b660
Source of Spectrum BS-1-57-0
Wiley ID 1414259