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1-(2'-Methyl-5'-nitro-1'H-imidazol-1'-yl)propan-2-yl-4"-fluoro benzoate
SpectraBase Compound ID Kaobi71ClXN
InChI InChI=1S/C14H14FN3O4/c1-9(8-17-10(2)16-7-13(17)18(20)21)22-14(19)11-3-5-12(15)6-4-11/h3-7,9H,8H2,1-2H3
InChIKey OVWVFTNOMVUZFG-UHFFFAOYSA-N
Mol Weight 307.28 g/mol
Molecular Formula C14H14FN3O4
Exact Mass 307.096834 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JeHnfv3b736
Name 1-(2'-Methyl-5'-nitro-1'H-imidazol-1'-yl)propan-2-yl-4"-fluoro benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14FN3O4
InChI InChI=1S/C14H14FN3O4/c1-9(8-17-10(2)16-7-13(17)18(20)21)22-14(19)11-3-5-12(15)6-4-11/h3-7,9H,8H2,1-2H3
InChIKey OVWVFTNOMVUZFG-UHFFFAOYSA-N
Instrument Name MAT 312 or MAT 113D
Ionization Type EI positive ion
Literature Reference DOI 10.1002/ardp.202100376
Molecular Weight 307.281 g/mol
SMILES c1cc(ccc1F)C(=O)OC(C[n]1c(cnc1C)[N+]([O-])=O)C
SPLASH splash10-00di-5920000000-d4a955320529a67f6d8a
Source of Spectrum APC-355-SM8-8
Wiley ID 1868728