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1-(2'-Methyl-5'-nitro-1'H-imidazol-1'-yl)propan-2-yl-3",5"-dimethoxybenzoate
SpectraBase Compound ID HamORLJ6dJL
InChI InChI=1S/C16H19N3O6/c1-10(9-18-11(2)17-8-15(18)19(21)22)25-16(20)12-5-13(23-3)7-14(6-12)24-4/h5-8,10H,9H2,1-4H3
InChIKey ZUVKLDONUWDSCI-UHFFFAOYSA-N
Mol Weight 349.34 g/mol
Molecular Formula C16H19N3O6
Exact Mass 349.127385 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CW3d9Wft4eU
Name 1-(2'-Methyl-5'-nitro-1'H-imidazol-1'-yl)propan-2-yl-3",5"-dimethoxybenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19N3O6
InChI InChI=1S/C16H19N3O6/c1-10(9-18-11(2)17-8-15(18)19(21)22)25-16(20)12-5-13(23-3)7-14(6-12)24-4/h5-8,10H,9H2,1-4H3
InChIKey ZUVKLDONUWDSCI-UHFFFAOYSA-N
Instrument Name MAT 312 or MAT 113D
Ionization Type EI positive ion
Literature Reference DOI 10.1002/ardp.202100376
Molecular Weight 349.343 g/mol
SMILES c1c(cc(cc1C(=O)OC(C[n]1c(cnc1C)[N+]([O-])=O)C)OC)OC
SPLASH splash10-0uxr-7901000000-83c6a16f16eda1707739
Source of Spectrum APC-355-SM21-21
Wiley ID 1868715