SpectraBase Spectrum ID |
AYgrPUtuCiH |
Name |
2-Ethyl-4-nitro-5-[1-(phenylsulfonyl)propyl]-2H-indazole |
Appearance |
Yellow prisms |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H19N3O4S |
InChI |
InChI=1S/C18H19N3O4S/c1-3-17(26(24,25)13-8-6-5-7-9-13)14-10-11-16-15(18(14)21(22)23)12-20(4-2)19-16/h5-12,17H,3-4H2,1-2H3 |
InChIKey |
IFFHSCNLOJHRKA-UHFFFAOYSA-N |
Instrument Name |
AMD Intectra Mass AMD 402 |
Ionization Type |
EI |
Literature Reference DOI |
10.3998/ark.5550190.0013.816 |
Molecular Weight |
373.427 g/mol |
SMILES |
c1(ccc2n[n](cc2c1[N+](=O)[O-])CC)C(S(c1ccccc1)(=O)=O)CC |
SPLASH |
splash10-001i-0090000000-ec73c7367eba27927ccd |
Source of Spectrum |
ARK-2012-183-21 |
Wiley ID |
1864759 |