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1-(2'-Methyl-5'-nitro-1'H-imidazol-1'-yl)propan-2-yl-2"-fluoro benzoate
SpectraBase Compound ID 7mJHmwzdxQl
InChI InChI=1S/C14H14FN3O4/c1-9(8-17-10(2)16-7-13(17)18(20)21)22-14(19)11-5-3-4-6-12(11)15/h3-7,9H,8H2,1-2H3
InChIKey QPSBZAKNPMCOAD-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 WWOwdUppXd
Name 1-(2'-Methyl-5'-nitro-1'H-imidazol-1'-yl)propan-2-yl-2"-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)11-5-3-4-6-12(11)15/h3-7,9H,8H2,1-2H3
InChIKey QPSBZAKNPMCOAD-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 c1c(c(ccc1)C(=O)OC(C[n]1c(cnc1C)[N+]([O-])=O)C)F
SPLASH splash10-022a-6940000000-baaf77625dfac37cffe6
Source of Spectrum APC-355-SM7-7
Wiley ID 1868727