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Ethyl 2-fluoro-2-(3-methyl-5-nitro-2-thioxo-2,3-dihydro-1H-benzo[d]imidazol-1-yl)acetate
SpectraBase Compound ID 2qGJZgdpq6U
InChI InChI=1S/C12H12FN3O4S/c1-3-20-11(17)10(13)15-8-5-4-7(16(18)19)6-9(8)14(2)12(15)21/h4-6,10H,3H2,1-2H3
InChIKey PXRGDAPQAXXRBX-UHFFFAOYSA-N
Mol Weight 313.3 g/mol
Molecular Formula C12H12FN3O4S
Exact Mass 313.053255 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DHtRfjQtEBA
Name Ethyl 2-fluoro-2-(3-methyl-5-nitro-2-thioxo-2,3-dihydro-1H-benzo[d]imidazol-1-yl)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12FN3O4S
InChI InChI=1S/C12H12FN3O4S/c1-3-20-11(17)10(13)15-8-5-4-7(16(18)19)6-9(8)14(2)12(15)21/h4-6,10H,3H2,1-2H3
InChIKey PXRGDAPQAXXRBX-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201801166
Molecular Weight 313.303 g/mol
SMILES C(C)OC(C(N1C(N(c2c1ccc(c2)[N+](=O)[O-])C)=S)F)=O
SPLASH splash10-0006-0496000000-427bbfdb20d6f75ec145
Source of Spectrum ASC-360-4801-14
Wiley ID 1812230