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4-Isoxazolamine, N-[(1,1-dimethylethyl)carbonimidoyl]-5-methyl-
SpectraBase Compound ID DST3axaYliZ
InChI InChI=1S/C9H13N3O/c1-7-8(5-12-13-7)10-6-11-9(2,3)4/h5H,1-4H3
InChIKey YMKIDRPXDVBBOR-UHFFFAOYSA-N
Mol Weight 179.22 g/mol
Molecular Formula C9H13N3O
Exact Mass 179.105862 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8ln9jag5Sh4
Name 4-Isoxazolamine, N-[(1,1-dimethylethyl)carbonimidoyl]-5-methyl-
CAS Registry Number 122686-23-1
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13N3O
InChI InChI=1S/C9H13N3O/c1-7-8(5-12-13-7)10-6-11-9(2,3)4/h5H,1-4H3
InChIKey YMKIDRPXDVBBOR-UHFFFAOYSA-N
Molecular Weight 179.223 g/mol
SMILES c1(c(onc1)C)N=C=NC(C)(C)C
SPLASH splash10-004i-0900000000-0de1d5f1f63fa2504f0f
Source of Spectrum H-72-566-5
Synonyms N-(t-butyl)-N'-(5-methylisoxazol-4-yl)carbodiimide N-(tert-butyl)-N'-(5-methyl-4-isoxazolyl)carbodiimide
Wiley ID 1175127