SpectraBase Spectrum ID |
6gEhjidEsjU |
Name |
1-(2'-Methyl-5'-nitro-1'H-imidazol-1'-yl)propan-2-yl-4"-tert-butylbenzoate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H23N3O4 |
InChI |
InChI=1S/C18H23N3O4/c1-12(11-20-13(2)19-10-16(20)21(23)24)25-17(22)14-6-8-15(9-7-14)18(3,4)5/h6-10,12H,11H2,1-5H3 |
InChIKey |
HSHLZGWFWNKPDG-UHFFFAOYSA-N |
Instrument Name |
MAT 312 or MAT 113D |
Ionization Type |
EI positive ion |
Literature Reference DOI |
10.1002/ardp.202100376 |
Molecular Weight |
345.399 g/mol |
SMILES |
c1cc(ccc1C(=O)OC(C[n]1c(cnc1C)[N+]([O-])=O)C)C(C)(C)C |
SPLASH |
splash10-01ot-3930000000-95323c69b280c26e4ef1 |
Source of Spectrum |
APC-355-SM17-17 |
Wiley ID |
1868711 |