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5,8-Etheno-1H-cyclobuta[d][1,2,4]triazolo[1,2-a]pyridazine-1,3(2H)-dione, 5,5a,6,7,7a,8-hexahydro-6-(1-methylethyl)-2-phenyl-
SpectraBase Compound ID 63Pdu1tlHyv
InChI InChI=1S/C19H21N3O2/c1-11(2)13-10-14-15-8-9-16(17(13)14)22-19(24)20(18(23)21(15)22)12-6-4-3-5-7-12/h3-9,11,13-17H,10H2,1-2H3
InChIKey NJERPTJIUOZYQS-UHFFFAOYSA-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 6cxPouT0fbE
Name 5,8-Etheno-1H-cyclobuta[d][1,2,4]triazolo[1,2-a]pyridazine-1,3(2H)-dione, 5,5a,6,7,7a,8-hexahydro-6-(1-methylethyl)-2-phenyl-
CAS Registry Number 99141-07-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21N3O2
InChI InChI=1S/C19H21N3O2/c1-11(2)13-10-14-15-8-9-16(17(13)14)22-19(24)20(18(23)21(15)22)12-6-4-3-5-7-12/h3-9,11,13-17H,10H2,1-2H3
InChIKey NJERPTJIUOZYQS-UHFFFAOYSA-N
Molecular Weight 323.396 g/mol
SMILES C1(N2N(C(N1c1ccccc1)=O)C1C=CC2C2C1CC2C(C)C)=O
SPLASH splash10-00tf-9204000000-e83a1ae005372780b02e
Source of Spectrum K-118-3378-7
Synonyms 3-Isopropyl-N-phenyl-7,8-diazatricyclo[4.2.2.0(2,5)]dec-9-ene-7,8-dicarboximide 9-isopropyl-4-phenyl-2,4,6-triazatetracyclo[5.4.2.0(2,6).0(8,11)]tridec-12-ene-3,5-dione
Wiley ID 1322538