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4-Acetyl-2-(deuterioacetamido)-5-phenyl-.delta.2-1,3,4-thiadiazoline
SpectraBase Compound ID KNhFoCuGMrm
InChI InChI=1S/C12H13N3O2S/c1-8(16)13-12-14-15(9(2)17)11(18-12)10-6-4-3-5-7-10/h3-7,11H,1-2H3,(H,13,14,16)/i1D3
InChIKey TYZWEONFZGQVSK-FIBGUPNXSA-N
Mol Weight 266.33 g/mol
Molecular Formula C12H102D3N3O2S
Exact Mass 266.091678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8gKALTdl55
Name 4-Acetyl-2-(deuterioacetamido)-5-phenyl-.delta.2-1,3,4-thiadiazoline
CAS Registry Number 72926-08-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10D3N3O2S
InChI InChI=1S/C12H13N3O2S/c1-8(16)13-12-14-15(9(2)17)11(18-12)10-6-4-3-5-7-10/h3-7,11H,1-2H3,(H,13,14,16)/i1D3
InChIKey TYZWEONFZGQVSK-FIBGUPNXSA-N
Molecular Weight 266.333 g/mol
SMILES N(C1=NN(C(S1)c1ccccc1)C(=O)C)C(=O)C([2D])([2D])[2D]
SPLASH splash10-00di-6790000000-ad3af7ccb6614696020c
Source of Spectrum J-45-1476-0
Wiley ID 104170