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(R)-2-fluoro-4-(2-iodopropyl)-1-methoxybenzene
SpectraBase Compound ID 3IGFtICIqGo
InChI InChI=1S/C10H12FIO/c1-7(12)5-8-3-4-10(13-2)9(11)6-8/h3-4,6-7H,5H2,1-2H3/t7-/m1/s1
InChIKey SDDCHPYUWXZDOP-SSDOTTSWSA-N
Mol Weight 294.11 g/mol
Molecular Formula C10H12FIO
Exact Mass 293.991688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3DfkycA1h2
Name (R)-2-fluoro-4-(2-iodopropyl)-1-methoxybenzene
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 293.991688168 u
Formula C10H12FIO
InChI InChI=1S/C10H12FIO/c1-7(12)5-8-3-4-10(13-2)9(11)6-8/h3-4,6-7H,5H2,1-2H3/t7-/m1/s1
InChIKey SDDCHPYUWXZDOP-SSDOTTSWSA-N
Instrument Name FINNIGAN MAT 95Q
Ionization Type EI
Literature Reference DOI 10.1002/anie.202214377
Molecular Weight 294.108 g/mol
Optical Rotation [a]D20 = -31.9 (c = 1.00, CHCl3)
Quality 127
Reported Formula C10H12FIO
SMILES C=1(F)C=C(C=CC1OC)C[C@](I)(C)[H]
SPLASH splash10-00kr-0900000000-9921571ad22ad84824f2
Sample Comments 95% ee
Source of Spectrum ACI-62-SM35-(R)-2e (DOI: 10.1002/anie.202214377)
Wiley ID 1908201