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1-(2-Chloro-2,3,3,3-tetrafluoropropyl)-1H-indazole
SpectraBase Compound ID F1386sNfTw8
InChI InChI=1S/C10H7ClF4N2/c11-9(12,10(13,14)15)6-17-5-7-3-1-2-4-8(7)16-17/h1-5H,6H2
InChIKey NIFSAONNNRYXHM-UHFFFAOYSA-N
Mol Weight 266.63 g/mol
Molecular Formula C10H7ClF4N2
Exact Mass 266.023389 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ZkWyzEwKMi
Name 1-(2-Chloro-2,3,3,3-tetrafluoropropyl)-1H-indazole
Appearance White solid
Carrier Gas Helium
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Exact Mass 266.023388585 u
Formula C10H7ClF4N2
GC Oven Program Oven temp 200 oC
InChI InChI=1S/C10H7ClF4N2/c11-9(12,10(13,14)15)6-17-5-7-3-1-2-4-8(7)16-17/h1-5H,6H2
InChIKey NIFSAONNNRYXHM-UHFFFAOYSA-N
Instrument Name Agilent 6890N-5973 GC
Ionization Type EI
Literature Reference DOI 10.1002/anie.202208420
Molecular Weight 266.627 g/mol
Quality 399
Reported Formula C10H7ClF4N2
SMILES C1=CC=2C(=CN(CC(F)(Cl)C(F)(F)F)N2)C=C1
SPLASH splash10-0gc0-6960000000-fd9fcacbb1ef93bc28c5
Source of Spectrum ACI-61-SM55-53 (DOI: 10.1002/anie.202208420)
Thin-Layer Chromatography 0.43 (hexane/ethyl acetate, 4:1)
Wiley ID 1897984