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2-Phenyl-2,3-dihydro-1-benzothiophene
SpectraBase Compound ID J0HfMjbWY7n
InChI InChI=1S/C14H12S/c1-2-6-11(7-3-1)14-10-12-8-4-5-9-13(12)15-14/h1-9,14H,10H2
InChIKey XHYKMNNXNAYROZ-UHFFFAOYSA-N
Mol Weight 212.31 g/mol
Molecular Formula C14H12S
Exact Mass 212.065972 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID xiM5PAORAS
Name 2-phenyl-2,3-dihydrobenzothiophene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 212.065971560 u
Formula C14H12S
InChI InChI=1S/C14H12S/c1-2-6-11(7-3-1)14-10-12-8-4-5-9-13(12)15-14/h1-9,14H,10H2
InChIKey XHYKMNNXNAYROZ-UHFFFAOYSA-N
Instrument Name Agilent 5975 MSD
Ionization Type EI
Literature Reference DOI 10.1021/jacs.2c02102
Molecular Weight 212.310 g/mol
Quality 61
SMILES C1C(SC2=C1C=CC=C2)C1=CC=CC=C1
SPLASH splash10-03di-0590000000-245fde88885884e0e247
Source of Spectrum C-144-SM53-40 (DOI: 10.1021/jacs.2c02102)
Wiley ID 1910596