(E)-1-[2-(3,3-Dimethyltriaz-1-enyl)-5-(phenylethynyl)phenyl]-2,2-dimethyl-3-phenylpropane-1,3-dione

SpectraBase Compound ID	5W8bxHNmbTA
InChI	InChI=1S/C27H25N3O2/c1-27(2,25(31)22-13-9-6-10-14-22)26(32)23-19-21(16-15-20-11-7-5-8-12-20)17-18-24(23)28-29-30(3)4/h5-14,17-19H,1-4H3/b29-28+
InChIKey	NNSQCPKVDTYWKX-ZQHSETAFSA-N Google Search
Mol Weight	423.52 g/mol
Molecular Formula	C27H25N3O2
Exact Mass	423.194677 g/mol

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SpectraBase Spectrum ID	ClMoq9IM5fG
Name	(E)-1-[2-(3,3-Dimethyltriaz-1-enyl)-5-(phenylethynyl)phenyl]-2,2-dimethyl-3-phenylpropane-1,3-dione
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C27H25N3O2
InChI	InChI=1S/C27H25N3O2/c1-27(2,25(31)22-13-9-6-10-14-22)26(32)23-19-21(16-15-20-11-7-5-8-12-20)17-18-24(23)28-29-30(3)4/h5-14,17-19H,1-4H3/b29-28+
InChIKey	NNSQCPKVDTYWKX-ZQHSETAFSA-N
Molecular Weight	423.516 g/mol
SMILES	C(C(c1c(\N=N\N(C)C)ccc(C#Cc2ccccc2)c1)=O)(C(=O)c1ccccc1)(C)C
SPLASH	splash10-0a6r-4900000000-b8923239eb84d3731c1c
Source of Spectrum	U1-2013-7417-3q
Synonyms	(E)-1-(2-(3,3-dimethyltriaz-1-en-1-yl)-5-(phenylethynyl)phenyl)-2,2-dimethyl-3-phenylpropane-1,3-dione
Wiley ID	1736214