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2-Amino-5-(2-p-phenetidinoethyl)-1,3,4-thiadiazole
SpectraBase Compound ID CIOKEgfUSz7
InChI InChI=1S/C12H16N4OS/c1-2-17-10-5-3-9(4-6-10)14-8-7-11-15-16-12(13)18-11/h3-6,14H,2,7-8H2,1H3,(H2,13,16)
InChIKey ZOHHWKIDDFCNKK-UHFFFAOYSA-N
Mol Weight 264.35 g/mol
Molecular Formula C12H16N4OS
Exact Mass 264.104482 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LrlRGAd2zzR
Name 2-Amino-5-(2-p-phenetidinoethyl)-1,3,4-thiadiazole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 264.104482324 u
Formula C12H16N4OS
InChI InChI=1S/C12H16N4OS/c1-2-17-10-5-3-9(4-6-10)14-8-7-11-15-16-12(13)18-11/h3-6,14H,2,7-8H2,1H3,(H2,13,16)
InChIKey ZOHHWKIDDFCNKK-UHFFFAOYSA-N
Molecular Weight 264.347 g/mol
SMILES N(C=1C=CC(=CC1)OCC)CCC1=NN=C(N)S1