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4-(5'-Nitro-2'-thienenyl)-3-buten-2-one
SpectraBase Compound ID 1QrTPwtk8H0
InChI InChI=1S/C8H7NO3S/c1-6(10)2-3-7-4-5-13-8(7)9(11)12/h2-5H,1H3/b3-2+
InChIKey NCHUDGNJSUNYSR-NSCUHMNNSA-N
Mol Weight 197.21 g/mol
Molecular Formula C8H7NO3S
Exact Mass 197.014664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JWBL4O3IK4b
Name 4-(5'-Nitro-2'-thienenyl)-3-buten-2-one
Alternate Name(s) (3E)-4-(2-nitro-3-thienyl)-3-buten-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7NO3S
InChI InChI=1S/C8H7NO3S/c1-6(10)2-3-7-4-5-13-8(7)9(11)12/h2-5H,1H3/b3-2+
InChIKey NCHUDGNJSUNYSR-NSCUHMNNSA-N
Molecular Weight 197.208 g/mol
SMILES c1(N(=O)=O)c(\C=C\C(=O)C)ccs1
SPLASH splash10-0005-9600000000-54e0f45a7e5af7bfe223
Source of Spectrum K1-2000-1658-4
Wiley ID 750105