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Benzothiophene-3-carboxaldehyde-d2
SpectraBase Compound ID HVUhUevBa2t
InChI InChI=1S/C9H6OS/c10-5-7-6-11-9-4-2-1-3-8(7)9/h1-6H/i3D,6D
InChIKey WDJLPQCBTBZTRH-OMYOYQAJSA-N
Mol Weight 164.22 g/mol
Molecular Formula C9H4D2OS
Exact Mass 164.026489 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I1fCYE3Nia9
Name Benzothiophene-3-carboxaldehyde-d2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H4D2OS
InChI InChI=1S/C9H6OS/c10-5-7-6-11-9-4-2-1-3-8(7)9/h1-6H/i3D,6D
InChIKey WDJLPQCBTBZTRH-OMYOYQAJSA-N
Instrument Name AMD 402
Ionization Type EI
Literature Reference DOI 10.1002/chem.202100468
Molecular Weight 164.218 g/mol
Quality 985
SMILES C1=C(C2=C(C=C1)SC(=C2C=O)[D])[D]
SPLASH splash10-03di-8900000000-816073798d504f2eacd2
Source of Spectrum QE-27-SM56-11-d2 (DOI: 10.1002/chem.202100468)
Wiley ID 1910211