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1H-[1,2,4]Triazolo[1,2-a]pyridazine-1,3(2H)-dione, 6-hexyl-5,8-dihydro-5,5,7-trimethyl-2-phenyl-
SpectraBase Compound ID BmILhzaGO9j
InChI InChI=1S/C21H29N3O2/c1-5-6-7-11-14-18-16(2)15-22-19(25)23(17-12-9-8-10-13-17)20(26)24(22)21(18,3)4/h8-10,12-13H,5-7,11,14-15H2,1-4H3
InChIKey RTWRKTBJKYHPIH-UHFFFAOYSA-N
Mol Weight 355.48 g/mol
Molecular Formula C21H29N3O2
Exact Mass 355.225977 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A6t6qGhz2g0
Name 1H-[1,2,4]Triazolo[1,2-a]pyridazine-1,3(2H)-dione, 6-hexyl-5,8-dihydro-5,5,7-trimethyl-2-phenyl-
CAS Registry Number 123718-30-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H29N3O2
InChI InChI=1S/C21H29N3O2/c1-5-6-7-11-14-18-16(2)15-22-19(25)23(17-12-9-8-10-13-17)20(26)24(22)21(18,3)4/h8-10,12-13H,5-7,11,14-15H2,1-4H3
InChIKey RTWRKTBJKYHPIH-UHFFFAOYSA-N
Molecular Weight 355.482 g/mol
SMILES C1(N2N(C(N1c1ccccc1)=O)C(C(=C(C2)C)CCCCCC)(C)C)=O
SPLASH splash10-052f-0329000000-dec1cefd11cf95c5c8ae
Source of Spectrum KC-1989-416-0
Synonyms 3-Hexyl-2,2,4-trimethyl-8-phenyl-1,6,8-triaza[4.3.0]bicyclonon-3-ene-7,9-dione 6-Hexyl-5,5,7-trimethyl-2-phenyl-5,8-dihydro-1H-[1,2,4]triazolo[1,2-a]pyridazine-1,3(2H)-dione
Wiley ID 1345359