SpectraBase Compound ID | Bs0SToVuN1T |
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InChI | InChI=1S/C8H3F6NO2/c9-7(10,11)4-2-1-3-5(8(12,13)14)6(4)15(16)17/h1-3H |
InChIKey | QBDVLQVFMYNRPV-UHFFFAOYSA-N |
Mol Weight | 259.11 g/mol |
Molecular Formula | C8H3F6NO2 |
Exact Mass | 259.006797 g/mol |
SpectraBase Spectrum ID | 1ncXCJfPCE1 |
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Name | 2-Nitro-1,3-bis(trifluoromethyl)benzene |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C8H3F6NO2 |
InChI | InChI=1S/C8H3F6NO2/c9-7(10,11)4-2-1-3-5(8(12,13)14)6(4)15(16)17/h1-3H |
InChIKey | QBDVLQVFMYNRPV-UHFFFAOYSA-N |
Molecular Weight | 259.107 g/mol |
SMILES | c1([N+]([O-])=O)c(C(F)(F)F)cccc1C(F)(F)F |
SPLASH | splash10-03e9-7690000000-eb58836c32f48a751a6e |
Source of Spectrum | QF-46-1135-0 |
Wiley ID | 833545 |