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1-tert-Butyl-4-phenyl-1,2,4-triazolidine-3,5-dione

View entire compound with spectra: 1 MS (GC)

1-tert-Butyl-4-phenyl-1,2,4-triazolidine-3,5-dione
SpectraBase Compound ID CCY8IMAJcHy
InChI InChI=1S/C12H15N3O2/c1-12(2,3)15-11(17)14(10(16)13-15)9-7-5-4-6-8-9/h4-8H,1-3H3,(H,13,16)
InChIKey XMHTUIGFCXGEBR-UHFFFAOYSA-N
Mol Weight 233.27 g/mol
Molecular Formula C12H15N3O2
Exact Mass 233.116427 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7mP2msE8c5O
Name 1-tert-Butyl-4-phenyl-1,2,4-triazolidine-3,5-dione
CAS Registry Number 64739-61-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15N3O2
InChI InChI=1S/C12H15N3O2/c1-12(2,3)15-11(17)14(10(16)13-15)9-7-5-4-6-8-9/h4-8H,1-3H3,(H,13,16)
InChIKey XMHTUIGFCXGEBR-UHFFFAOYSA-N
Molecular Weight 233.271 g/mol
SMILES N1C(N(C(N1C(C)(C)C)=O)c1ccccc1)=O
SPLASH splash10-056r-9500000000-c11bea0a5f6d6d897046
Source of Spectrum J-43-813-0
Synonyms 1-tert-Butyl-4-phenyl-urazole
Wiley ID 1234819