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5-(4-Bromophenyl)-5,8-dihydrotetrazolo[1,5-a]pyrimidine-7-carboxylic acid

View entire compound with spectra: 1 MS (GC)

5-(4-Bromophenyl)-5,8-dihydrotetrazolo[1,5-a]pyrimidine-7-carboxylic acid
SpectraBase Compound ID 27UyelHPt4v
InChI InChI=1S/C11H8BrN5O2/c12-7-3-1-6(2-4-7)8-5-9(10(18)19)17-11(13-8)14-15-16-17/h1-5,8H,(H,18,19)(H,13,14,16)
InChIKey FJFXIUSMJLPTBL-UHFFFAOYSA-N
Mol Weight 322.12 g/mol
Molecular Formula C11H8BrN5O2
Exact Mass 320.986138 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0iwz80GoYy
Name 5-(4-Bromophenyl)-5,8-dihydrotetrazolo[1,5-a]pyrimidine-7-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H8BrN5O2
InChI InChI=1S/C11H8BrN5O2/c12-7-3-1-6(2-4-7)8-5-9(10(18)19)17-11(13-8)14-15-16-17/h1-5,8H,(H,18,19)(H,13,14,16)
InChIKey FJFXIUSMJLPTBL-UHFFFAOYSA-N
Molecular Weight 322.122 g/mol
SMILES N1N=NC2=NC(C=C(C(=O)O)N12)c1ccc(cc1)Br
SPLASH splash10-01c0-0924000000-bff7a8ba74b60f3b8f5a
Source of Spectrum F4-0-2600-13
Synonyms 5-(4-bromophenyl)-1,5-dihydrotetraazolo[1,5-a]pyrimidine-7-carboxylic acid
Wiley ID 1618687