SpectraBase Spectrum ID |
39nVI3vA1o |
Name |
7-Nitro-1-(propylsulfonyl)-1,2,3,4-tetrahydroquinoline |
Appearance |
Yellow solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C12H16N2O4S |
InChI |
InChI=1S/C12H16N2O4S/c1-2-8-19(17,18)13-7-3-4-10-5-6-11(14(15)16)9-12(10)13/h5-6,9H,2-4,7-8H2,1H3 |
InChIKey |
CQFZSFIBQLEJSS-UHFFFAOYSA-N |
Instrument Name |
Shimadzu QP-5000 |
Ionization Type |
EI |
Literature Reference DOI |
10.1021/ml400487t |
Molecular Weight |
284.330 g/mol |
Reported Formula |
C12H16N2O4S |
SMILES |
c12cc([N+](=O)[O-])ccc2CCCN1S(=O)(=O)CCC |
SPLASH |
splash10-003r-0920000000-e27e3d3fa42858ad14a1 |
Source of Spectrum |
MCS-5-SM3-3 |
Wiley ID |
1864160 |