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7-Nitro-1-(propylsulfonyl)-1,2,3,4-tetrahydroquinoline
SpectraBase Compound ID KdyOLtqdcoi
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
Mol Weight 284.33 g/mol
Molecular Formula C12H16N2O4S
Exact Mass 284.083078 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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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