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2-nitro-N-(2,3,4,5,6-pentadeuteriophenyl)benzothiophen-3-amine
SpectraBase Compound ID 53jSMVoULTJ
InChI InChI=1S/C14H10N2O2S/c17-16(18)14-13(15-10-6-2-1-3-7-10)11-8-4-5-9-12(11)19-14/h1-9,15H/i1D,2D,3D,6D,7D
InChIKey ZQHXXAOMTMKWSQ-FSTBWYLISA-N
Mol Weight 275.34 g/mol
Molecular Formula C14H5D5N2O2S
Exact Mass 275.077682 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2yWWosQMYu
Name 2-nitro-N-(2,3,4,5,6-pentadeuteriophenyl)benzothiophen-3-amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H5D5N2O2S
InChI InChI=1S/C14H10N2O2S/c17-16(18)14-13(15-10-6-2-1-3-7-10)11-8-4-5-9-12(11)19-14/h1-9,15H/i1D,2D,3D,6D,7D
InChIKey ZQHXXAOMTMKWSQ-FSTBWYLISA-N
Instrument Name VG-7070E
Ionization Type EI
Literature Reference DOI 10.1002_(SICI)1097-0231(19990730)13_14_1360
Molecular Weight 275.337 g/mol
SMILES N(c1c2ccccc2sc1[N+](=O)[O-])c1c([D])c([D])c([D])c([D])c1[D]
SPLASH splash10-004i-1190000000-8ce404e0a7fa4a52d037
Source of Spectrum RCM-13-1362-9d5
Wiley ID 1838883