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4-(Azidomethyl)benzoic acid
SpectraBase Compound ID 5d86BQc6ryN
InChI InChI=1S/C8H7N3O2/c9-11-10-5-6-1-3-7(4-2-6)8(12)13/h1-4H,5H2,(H,12,13)
InChIKey QWRURNUFBGDSDL-UHFFFAOYSA-N
Mol Weight 177.16 g/mol
Molecular Formula C8H7N3O2
Exact Mass 177.053826 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EX9Y0eSwD4i
Name 4-(Azidomethyl)benzoic acid
Appearance colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7N3O2
InChI InChI=1S/C8H7N3O2/c9-11-10-5-6-1-3-7(4-2-6)8(12)13/h1-4H,5H2,(H,12,13)
InChIKey QWRURNUFBGDSDL-UHFFFAOYSA-N
Instrument Name Varian CH-5/Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.8.115
Molecular Weight 177.163 g/mol
SMILES OC(c1ccc(CN=[N+]=[N-])cc1)=O
SPLASH splash10-000j-0900000000-558062c8fe1ce4374145
Source of Spectrum BJO-8-1035-6
Wiley ID 1864880