SpectraBase Spectrum ID |
IQN5IakACmJ |
Name |
N-(1-Adamantyl)-5-(4-nitrophenoxy)methyl-1,3-oxathiolane-2-imine |
Appearance |
White microcrystals |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C20H24N2O4S |
InChI |
InChI=1S/C20H24N2O4S/c23-22(24)16-1-3-17(4-2-16)25-11-18-12-27-19(26-18)21-20-8-13-5-14(9-20)7-15(6-13)10-20/h1-4,13-15,18H,5-12H2/t13-,14+,15-,18?,20- |
InChIKey |
WOONHXLKIDNDOQ-RYPPKCAISA-N |
Instrument Name |
Finnigan DSQ GC-MS |
Ionization Type |
EI |
Literature Reference DOI |
10.3998/ark.5550190.0006.416 |
Molecular Weight |
388.482 g/mol |
SMILES |
C1[C@]2(C[C@]3(CC1(C[C@@](C2)(C3)[H])N=C1OC(CS1)COc1ccc(cc1)[N+]([O-])=O)[H])[H] |
SPLASH |
splash10-00di-9311000000-6cedf5b25db90e72eb14 |
Source of Spectrum |
ARK-2005-205-6d |
Wiley ID |
1873065 |