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1-(2'-Methyl-5'-nitro-1'H-imidazol-1'-yl)propan-2-yl-1"-naphthoate
SpectraBase Compound ID 6HSTwBnNkYr
InChI InChI=1S/C18H17N3O4/c1-12(11-20-13(2)19-10-17(20)21(23)24)25-18(22)16-9-5-7-14-6-3-4-8-15(14)16/h3-10,12H,11H2,1-2H3
InChIKey YBZWZHNVZNRSAZ-UHFFFAOYSA-N
Mol Weight 339.35 g/mol
Molecular Formula C18H17N3O4
Exact Mass 339.121906 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4PcqQ9CKZtf
Name 1-(2'-Methyl-5'-nitro-1'H-imidazol-1'-yl)propan-2-yl-1"-naphthoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17N3O4
InChI InChI=1S/C18H17N3O4/c1-12(11-20-13(2)19-10-17(20)21(23)24)25-18(22)16-9-5-7-14-6-3-4-8-15(14)16/h3-10,12H,11H2,1-2H3
InChIKey YBZWZHNVZNRSAZ-UHFFFAOYSA-N
Instrument Name MAT 312 or MAT 113D
Ionization Type EI positive ion
Literature Reference DOI 10.1002/ardp.202100376
Molecular Weight 339.351 g/mol
SMILES c12c(cccc1C(=O)OC(C[n]1c(cnc1C)[N+]([O-])=O)C)cccc2
SPLASH splash10-054o-5900000000-6d16eaaef041c47e41ea
Source of Spectrum APC-355-SM18-18
Wiley ID 1868712