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2-(Azidomethyl)-1-(ethylsulfinyl)-4-fluorobenzene
SpectraBase Compound ID KC931bx2y1r
InChI InChI=1S/C9H10FN3OS/c1-2-15(14)9-4-3-8(10)5-7(9)6-12-13-11/h3-5H,2,6H2,1H3
InChIKey XIJXRZGBQWTFTQ-UHFFFAOYSA-N
Mol Weight 227.26 g/mol
Molecular Formula C9H10FN3OS
Exact Mass 227.052861 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2K9RURJt9Ys
Name 2-(Azidomethyl)-1-(ethylsulfinyl)-4-fluorobenzene
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10FN3OS
InChI InChI=1S/C9H10FN3OS/c1-2-15(14)9-4-3-8(10)5-7(9)6-12-13-11/h3-5H,2,6H2,1H3
InChIKey XIJXRZGBQWTFTQ-UHFFFAOYSA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/anie.201804284
Molecular Weight 227.257 g/mol
Quality 29
SMILES C(N=[N+]=[N-])C1=C(C=CC(=C1)F)S(=O)CC
SPLASH splash10-0f89-0910000000-c8e1b0d5ac5c364e6764
Source of Spectrum ACI-57-SM11-3b (DOI: 10.1002/anie.201804284)
Thin-Layer Chromatography 0.32 (pentane/EtOAc, 1:1)
Wiley ID 1893353