Product Name3-FLUORO-4-HYDROXYPHENYLACETIC ACID
CAS458-09-3
Molecular FormulaC8H7FO3
Molecular Weight170.14
InChIInChI=1S/C8H7FO3/c9-6-3-5(4-8(11)12)1-2-7(6)10/h1-3,10H,4H2,(H,11,12)
InChIKey YRFBZAHYMOSSGX-UHFFFAOYSA-N
SmilesC1(CC(O)=O)=CC=C(O)C(F)=C1
Mass
MS-NW-6849 3-fluoro-4-hydroxyphenylacetic acid C8H7FO3 (Mass of molecular ion: 170)
Source Temperature: 270 °C Sample Temperature: 190 °C Reservoir, 75 eV
18.0 1.2 27.0 1.3 38.0 1.3 39.0 2.1 44.0 1.6 45.0 2.4 50.0 3.0 51.0 13.1 52.0 1.6 53.0 1.5 57.0 1.8 62.0 1.0 62.5 1.6 63.0 1.4 69.0 1.4 70.0 2.5 75.0 2.2 76.0 1.0 77.0 23.6 78.0 2.3 95.0 2.3 96.0 3.8 97.0 1.3 105.0 4.1 123.0 1.3 124.0 2.2 125.0 100.0 126.0 8.6 127.0 1.6 170.0 36.7 171.0 3.5
400 MHz in D2O
1H NMR | 399.65 MHz |
C8 H7 F O3 | 0.037 g : 0.5 ml D2O |
3-fluoro-4-hydroxyphenylacetic acid |
![]() |
Assign. Shift(ppm) |
Hz ppm Int.
2819.34 7.055 161 2817.50 7.050 177 2807.13 7.024 163 2805.42 7.020 179 2794.31 6.992 119 2785.89 6.971 288 2781.74 6.961 25 2777.34 6.950 266 2771.73 6.936 254 2769.90 6.931 238 2763.43 6.915 98 2761.60 6.911 97 1440.06 3.604 1000
KBr disc
nujol mull
3-FLUORO-4-HYDROXYPHENYLACETIC ACID(458-09-3) IR2 Atlas of Related Products
HomePage | Member Companies | Advertising | Contact us | Previous WebSite | MSDS | CAS Index | CAS DataBase
Copyright © 2017 ChemicalBook All rights reserved.