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2-(aminomethyl)-2-fluoro-benzofuran-3-one
SpectraBase Compound ID 8HBe1DHoQcm
InChI InChI=1S/C9H8FNO2/c10-9(5-11)8(12)6-3-1-2-4-7(6)13-9/h1-4H,5,11H2
InChIKey KCPQHSHXXYCWCD-UHFFFAOYSA-N
Mol Weight 181.17 g/mol
Molecular Formula C9H8FNO2
Exact Mass 181.053907 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID II15h1yPcnb
Name 2-(aminomethyl)-2-fluoro-benzofuran-3-one
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 181.053906663 u
Formula C9H8FNO2
InChI InChI=1S/C9H8FNO2/c10-9(5-11)8(12)6-3-1-2-4-7(6)13-9/h1-4H,5,11H2
InChIKey KCPQHSHXXYCWCD-UHFFFAOYSA-N
Instrument Name HP-5989
Ionization Type EI
Literature Reference DOI 10.1002/chem.201602545
Molecular Weight 181.166 g/mol
Quality 43
Reported Formula C9H8NO2F
SMILES NCC1(OC2=CC=CC=C2C1=O)F
SPLASH splash10-0udi-0900000000-d6354f9f5ef645da4515
Source of Spectrum QE-22-SM93-6 (DOI: 10.1002/chem.201602545)
Wiley ID 1905148