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2'-(Acetyl-2,2,2-d3)-1-methyl-pyrrole-3',4',5'-d3
SpectraBase Compound ID AqY7Os0rkJe
InChI InChI=1S/C7H9NO/c1-6(9)7-4-3-5-8(7)2/h3-5H,1-2H3/i1D3,3D,4D,5D
InChIKey NZFLWVDXYUGFAV-YFNZQJCKSA-N
Mol Weight 129.19 g/mol
Molecular Formula C7H3D6NO
Exact Mass 129.106074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HJyRXMH1uQQ
Name 2'-(Acetyl-2,2,2-d3)-1-methyl-pyrrole-3',4',5'-d3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 129.106074388 u
Formula C7H3D6NO
InChI InChI=1S/C7H9NO/c1-6(9)7-4-3-5-8(7)2/h3-5H,1-2H3/i1D3,3D,4D,5D
InChIKey NZFLWVDXYUGFAV-YFNZQJCKSA-N
Instrument Name AMD 402
Ionization Type EI
Literature Reference DOI 10.1002/chem.202100468
Molecular Weight 129.192 g/mol
Quality 1000
SMILES C=1(C(=C(N(C1C(=O)C([D])([D])[D])C)[D])[D])[D]
SPLASH splash10-03fr-9400000000-b45960e7e04406e96084
Source of Spectrum QE-27-SM71-28-d6 (DOI: 10.1002/chem.202100468)
Wiley ID 1910226