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3-Nitro-2-(2-thienyl)-2H-chromene
SpectraBase Compound ID 35ppyop4A3P
InChI InChI=1S/C13H9NO3S/c15-14(16)10-8-9-4-1-2-5-11(9)17-13(10)12-6-3-7-18-12/h1-8,13H
InChIKey XLVNDDXFQRTQKA-UHFFFAOYSA-N
Mol Weight 259.28 g/mol
Molecular Formula C13H9NO3S
Exact Mass 259.030314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID g2jHdKXBuN
Name 3-Nitro-2-(2-thienyl)-2H-chromene
Alternate Name(s) 3-Nitro-2-thiophen-2-yl-2H-1-benzopyran 3-Nitro-2-thiophen-2-yl-2H-chromene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H9NO3S
InChI InChI=1S/C13H9NO3S/c15-14(16)10-8-9-4-1-2-5-11(9)17-13(10)12-6-3-7-18-12/h1-8,13H
InChIKey XLVNDDXFQRTQKA-UHFFFAOYSA-N
Molecular Weight 259.279 g/mol
SMILES C=1(C(Oc2c(C1)cccc2)c1sccc1)N(=O)=O
SPLASH splash10-03di-0290000000-c84b80faccfb558280c8
Source of Spectrum O1-57-1042-3
Wiley ID 1591493