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1-(2'-Methyl-5'-nitro-1'H-imidazol-1'-yl)propan-2-yl-2"-bromobenzoate
SpectraBase Compound ID 459xCgxJuTY
InChI InChI=1S/C14H14BrN3O4/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 ZIVXSYWBRDAUFL-UHFFFAOYSA-N
Mol Weight 368.19 g/mol
Molecular Formula C14H14BrN3O4
Exact Mass 367.016769 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7abD63UlNNX
Name 1-(2'-Methyl-5'-nitro-1'H-imidazol-1'-yl)propan-2-yl-2"-bromobenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14BrN3O4
InChI InChI=1S/C14H14BrN3O4/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 ZIVXSYWBRDAUFL-UHFFFAOYSA-N
Instrument Name MAT 312 or MAT 113D
Ionization Type EI positive ion
Literature Reference DOI 10.1002/ardp.202100376
Molecular Weight 368.187 g/mol
SMILES c1cc(c(cc1)Br)C(=O)OC(C[n]1c(cnc1C)[N+]([O-])=O)C
SPLASH splash10-001r-1901000000-b21328030decc4db3b22
Source of Spectrum APC-355-SM2-2
Wiley ID 1868722