For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-Ethyl-4-nitro-5-[1-(phenylsulfonyl)propyl]-2H-indazole
SpectraBase Compound ID AfofKXkNbFV
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
Mol Weight 373.43 g/mol
Molecular Formula C18H19N3O4S
Exact Mass 373.109627 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

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