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3-[4-(2H-1,2,3,4-tetrazol-5-yl)phenyl]benzo[f]quinoline-1-carboxylic acid
SpectraBase Compound ID 2v3VWu8DM2
InChI InChI=1S/C21H13N5O2/c27-21(28)16-11-18(13-5-7-14(8-6-13)20-23-25-26-24-20)22-17-10-9-12-3-1-2-4-15(12)19(16)17/h1-11H,(H,27,28)(H,23,24,25,26)
InChIKey MBNWJVACJFAXNK-UHFFFAOYSA-N
Mol Weight 367.37 g/mol
Molecular Formula C21H13N5O2
Exact Mass 367.106925 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IwUq4RA3af5
Name 3-[4-(2H-1,2,3,4-tetrazol-5-yl)phenyl]benzo[f]quinoline-1-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H13N5O2
InChI InChI=1S/C21H13N5O2/c27-21(28)16-11-18(13-5-7-14(8-6-13)20-23-25-26-24-20)22-17-10-9-12-3-1-2-4-15(12)19(16)17/h1-11H,(H,27,28)(H,23,24,25,26)
InChIKey MBNWJVACJFAXNK-UHFFFAOYSA-N
Molecular Weight 367.368 g/mol
SMILES [nH]1c(-c2ccc(-c3nc4c(c(C(=O)O)c3)c3c(cc4)cccc3)cc2)nnn1
SPLASH splash10-0f6x-8961000000-7f67adf7b1524482b0b1
Synonyms 3-[4-(2H-tetrazol-5-yl)phenyl]-1-benzo[f]quinolinecarboxylic acid 3-[4-(2H-tetrazol-5-yl)phenyl]benzo[f]quinoline-1-carboxylic acid
Wiley ID 1451567