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2-Propen-1-one, 2-azido-1-(4-chlorophenyl)-3-[2-(hydroxymethyl)phenyl]-
SpectraBase Compound ID DafDo6UiOxp
InChI InChI=1S/C16H12ClN3O2/c17-14-7-5-11(6-8-14)16(22)15(19-20-18)9-12-3-1-2-4-13(12)10-21/h1-9,21H,10H2/b15-9-
InChIKey AFQIBZFSWUNZCS-DHDCSXOGSA-N
Mol Weight 313.74 g/mol
Molecular Formula C16H12ClN3O2
Exact Mass 313.061804 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9OsqvvXu8uc
Name 2-Propen-1-one, 2-azido-1-(4-chlorophenyl)-3-[2-(hydroxymethyl)phenyl]-
CAS Registry Number 117825-86-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12ClN3O2
InChI InChI=1S/C16H12ClN3O2/c17-14-7-5-11(6-8-14)16(22)15(19-20-18)9-12-3-1-2-4-13(12)10-21/h1-9,21H,10H2/b15-9-
InChIKey AFQIBZFSWUNZCS-DHDCSXOGSA-N
Molecular Weight 313.744 g/mol
SMILES OCc1c(\C=C\(C(c2ccc(cc2)Cl)=O)N=[N+]=[N-])cccc1
SPLASH splash10-000i-5920000000-a3a63b4f6724556e3e2a
Source of Spectrum AH-119-231-5
Synonyms (2Z)-2-azido-1-(4-chlorophenyl)-3-[2-(hydroxymethyl)phenyl]-2-propen-1-one 1-(4-Chlorophenyl)-2-azido-3-(o-hydroxymethylolphenyl)-2-propene-1-one
Wiley ID 1314154