3-(5-Bromo-3-nitro-1H-1,2,4-triazol-1-yl)tricyclo[3.3.1.1~3,7~]decane-1-carboxylic acid

SpectraBase Compound ID	DY1QFtLbfjp
InChI	InChI=1S/C13H15BrN4O4/c14-10-15-11(18(21)22)16-17(10)13-4-7-1-8(5-13)3-12(2-7,6-13)9(19)20/h7-8H,1-6H2,(H,19,20)
InChIKey	DIYLKADNFMGZCX-UHFFFAOYSA-N Google Search
Mol Weight	371.19 g/mol
Molecular Formula	C13H15BrN4O4
Exact Mass	370.027668 g/mol

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SpectraBase Spectrum ID	ALk5f0XM4RF
Name	3-(5-Bromo-3-nitro-1H-1,2,4-triazol-1-yl)tricyclo[3.3.1.1~3,7~]decane-1-carboxylic acid
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C13H15BrN4O4
InChI	InChI=1S/C13H15BrN4O4/c14-10-15-11(18(21)22)16-17(10)13-4-7-1-8(5-13)3-12(2-7,6-13)9(19)20/h7-8H,1-6H2,(H,19,20)
InChIKey	DIYLKADNFMGZCX-UHFFFAOYSA-N
Molecular Weight	371.191 g/mol
SMILES	OC(C12CC3([n]4nc(nc4Br)N(=O)=O)CC(C1)CC(C2)C3)=O
SPLASH	splash10-004i-3900000000-c9e2ea625d421f6649ce
Synonyms	(5R,7S)-3-(5-bromo-3-nitro-1H-1,2,4-triazol-1-yl)tricyclo[3.3.1.1(3,7)]decane-1-carboxylic acid 3-(5-Bromo-3-nitro-1H-1,2,4-triazol-1-yl)tricyclo[3.3.1.1(3,7)]decane-1-carboxylic acid 3-(5-Bromo-3-nitro-[1,2,4]triazol-1-yl)-adamantane-1-carboxylic acid
Wiley ID	1511007