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5,10-Etheno-1H-[1,2,4]triazolo[1,2-a][1,2]diazocine-1,3(2H)-dione, 5,6,9,10-tetrahydro-6-(1-methylethyl)-2-phenyl-
SpectraBase Compound ID LkZNYnQnGWu
InChI InChI=1S/C19H21N3O2/c1-13(2)16-10-6-9-15-11-12-17(16)22-19(24)20(18(23)21(15)22)14-7-4-3-5-8-14/h3-8,10-13,15-17H,9H2,1-2H3/b10-6-
InChIKey IBIRBQIEFBMIJW-POHAHGRESA-N
Mol Weight 323.4 g/mol
Molecular Formula C19H21N3O2
Exact Mass 323.163377 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 62ScywUvKyi
Name 5,10-Etheno-1H-[1,2,4]triazolo[1,2-a][1,2]diazocine-1,3(2H)-dione, 5,6,9,10-tetrahydro-6-(1-methylethyl)-2-phenyl-
CAS Registry Number 99141-08-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21N3O2
InChI InChI=1S/C19H21N3O2/c1-13(2)16-10-6-9-15-11-12-17(16)22-19(24)20(18(23)21(15)22)14-7-4-3-5-8-14/h3-8,10-13,15-17H,9H2,1-2H3/b10-6-
InChIKey IBIRBQIEFBMIJW-POHAHGRESA-N
Molecular Weight 323.396 g/mol
SMILES C1(N2N(C(N1c1ccccc1)=O)C1C\C=C/C(C2C=C1)C(C)C)=O
SPLASH splash10-003r-9380000000-75e7f90a739b50ffce52
Source of Spectrum K-118-3379-7
Synonyms 2-Isopropyl-N-phenyl-7,8-diazabicyclo[4.2.2]deca-3,9-diene-7,8-dicarboximide 8-isopropyl-4-phenyl-2,4,6-triazatricyclo[5.4.2.0(2,6)]trideca-9,12-diene-3,5-dione
Wiley ID 1322539