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3-Phenyl-4-(1,2,3,4-tetrazol-1-yl)butanoic acid
SpectraBase Compound ID 7DvIoxNRdoC
InChI InChI=1S/C11H12N4O2/c16-11(17)6-10(7-15-8-12-13-14-15)9-4-2-1-3-5-9/h1-5,8,10H,6-7H2,(H,16,17)
InChIKey BXRQAQUJNCMHOC-UHFFFAOYSA-N
Mol Weight 232.24 g/mol
Molecular Formula C11H12N4O2
Exact Mass 232.096026 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9E66RoM4um7
Name 3-Phenyl-4-(1,2,3,4-tetrazol-1-yl)butanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12N4O2
InChI InChI=1S/C11H12N4O2/c16-11(17)6-10(7-15-8-12-13-14-15)9-4-2-1-3-5-9/h1-5,8,10H,6-7H2,(H,16,17)
InChIKey BXRQAQUJNCMHOC-UHFFFAOYSA-N
Molecular Weight 232.243 g/mol
SMILES OC(CC(C[n]1nnnc1)c1ccccc1)=O
SPLASH splash10-03di-2900000000-7a4a4a7fa62057e6017e
Synonyms 3-Phenyl-4-(1-tetrazolyl)butanoic acid 3-Phenyl-4-(tetrazol-1-yl)butanoic acid 3-Phenyl-4-(tetrazol-1-yl)butyric acid Butyric acid, 3-phenyl-4-(tetrazol-1-yl)-
Wiley ID 1446849