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4-Amino-6-(2,2-dimethylpropyl)-3-sulfanylidene-1,2,4-triazinan-5-one
SpectraBase Compound ID K8A1oRVMH22
InChI InChI=1S/C8H16N4OS/c1-8(2,3)4-5-6(13)12(9)7(14)11-10-5/h5,10H,4,9H2,1-3H3,(H,11,14)
InChIKey YUXAGOWTLBXNKT-UHFFFAOYSA-N
Mol Weight 216.3 g/mol
Molecular Formula C8H16N4OS
Exact Mass 216.104482 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KNc7wcye0V9
Name 4-Amino-6-(2,2-dimethylpropyl)-3-sulfanylidene-1,2,4-triazinan-5-one
CAS Registry Number 94128-13-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H16N4OS
InChI InChI=1S/C8H16N4OS/c1-8(2,3)4-5-6(13)12(9)7(14)11-10-5/h5,10H,4,9H2,1-3H3,(H,11,14)
InChIKey YUXAGOWTLBXNKT-UHFFFAOYSA-N
Molecular Weight 216.303 g/mol
SMILES N1C(C(N(C(N1)=S)N)=O)CC(C)(C)C
SPLASH splash10-0aor-9310000000-4367817de4116f9341db
Source of Spectrum Y-22-13-3
Synonyms 4-Amino-6-(2,2-dimethylpropyl)-3-thioxo-1,2,4-triazinan-5-one 4-Amino-6-neopentyl-3-thioxo-1,2,4-triazinan-5-one 4-Azanyl-6-(2,2-dimethylpropyl)-3-sulfanylidene-1,2,4-triazinan-5-one
Wiley ID 1215005