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(E)-(1-(5-bromo-2-(3,3-dimethyltriaz-1-en-1-yl)benzoyl)cyclopropyl)(pyridin-2-yl)methanone
SpectraBase Compound ID 2w5Huw7Ykkt
InChI InChI=1S/C18H17BrN4O2/c1-23(2)22-21-14-7-6-12(19)11-13(14)16(24)18(8-9-18)17(25)15-5-3-4-10-20-15/h3-7,10-11H,8-9H2,1-2H3/b22-21+
InChIKey UIYNMHFTJOIDCL-QURGRASLSA-N
Mol Weight 401.26 g/mol
Molecular Formula C18H17BrN4O2
Exact Mass 400.053489 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 21wtr8z0qUQ
Name (E)-(1-(5-bromo-2-(3,3-dimethyltriaz-1-en-1-yl)benzoyl)cyclopropyl)(pyridin-2-yl)methanone
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Formula C18H17BrN4O2
InChI InChI=1S/C18H17BrN4O2/c1-23(2)22-21-14-7-6-12(19)11-13(14)16(24)18(8-9-18)17(25)15-5-3-4-10-20-15/h3-7,10-11H,8-9H2,1-2H3/b22-21+
InChIKey UIYNMHFTJOIDCL-QURGRASLSA-N
Literature Reference DOI 10.1021/ol400223d
Molecular Weight 401.264 g/mol
SMILES C1(C(c2c(ccc(c2)Br)\N=N\N(C)C)=O)(CC1)C(c1ccccn1)=O
SPLASH splash10-004i-9312000000-1c61d77cb3237c77456b
Source of Spectrum A1-15-1282/SM15-1_2o
Wiley ID 1748411