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3,3-bis(3-fluorophenyl)-2-methyl-propanenitrile
SpectraBase Compound ID AkfI0dLbp1M
InChI InChI=1S/C16H13F2N/c1-11(10-19)16(12-4-2-6-14(17)8-12)13-5-3-7-15(18)9-13/h2-9,11,16H,1H3
InChIKey VGHPJINDFDBMGQ-UHFFFAOYSA-N
Mol Weight 257.28 g/mol
Molecular Formula C16H13F2N
Exact Mass 257.101606 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IBJdQJtMcMY
Name 3,3-bis(3-fluorophenyl)-2-methyl-propanenitrile
Appearance Clear oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13F2N
InChI InChI=1S/C16H13F2N/c1-11(10-19)16(12-4-2-6-14(17)8-12)13-5-3-7-15(18)9-13/h2-9,11,16H,1H3
InChIKey VGHPJINDFDBMGQ-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 257.284 g/mol
SMILES C(C(C#N)C)(c1cc(ccc1)F)c1cccc(c1)F
SPLASH splash10-0ue9-0690000000-cd87a732e4f4ef6ec80c
Source of Spectrum JP2012102130A
Wiley ID 1846664