4-Hydroxyphenethyl alcohol(501-94-0) MS
Product Name4-Hydroxyphenethyl alcohol
CAS501-94-0
Molecular FormulaC8H10O2
Molecular Weight138.16
InChIInChI=1S/C8H10O2/c9-6-5-7-1-3-8(10)4-2-7/h1-4,9-10H,5-6H2
InChIKey YCCILVSKPBXVIP-UHFFFAOYSA-N
SmilesC1(CCO)=CC=C(O)C=C1
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MassMS-IW-2150 p-hydroxyphenethyl alcohol C8H10O2 (Mass of molecular ion: 138)
Source Temperature: 220 °C Sample Temperature: 160 °C Reservoir, 75 eV
18.0 3.0 27.0 1.6 31.0 1.4 39.0 2.9 50.0 1.2 51.0 3.0 52.0 1.5 53.0 2.5 55.0 1.2 63.0 1.3 65.0 1.6 77.0 10.7 78.0 2.7 79.0 2.3 91.0 2.6 107.0 100.0 108.0 9.5 119.0 1.0 121.0 3.1 122.0 1.9 138.0 19.9 139.0 1.7 146.0 1.5 161.0 1.0 163.0 1.1 181.0 1.3
400 MHz in DMSO-d6
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1H NMR 399.65 MHz C8 H10 O2 0.031 g : 0.5 ml DMSO-d6 p-hydroxyphenethyl alcohol 
Assign. Shift(ppm)
A 9.14 B 6.993 C 6.668 D 4.59 E 3.531 F 2.607 J(D,E)=5.2HZ
Hz ppm Int.3652.95 9.141 1000 2802.28 7.012 51 2799.53 7.005 493 2797.39 7.000 170 2793.12 6.989 176 2790.99 6.984 555 2788.09 6.977 74 2671.66 6.686 78 2668.91 6.679 705 2666.78 6.673 213 2662.35 6.662 196 2660.37 6.657 614 2657.47 6.650 72 1840.52 4.606 248 1835.33 4.593 564 1829.99 4.579 259 1421.51 3.557 196 1416.17 3.544 205 1414.34 3.539 359 1409.15 3.526 364 1407.01 3.521 224 1401.67 3.508 209 1049.19 2.626 281 1042.02 2.608 515 1034.70 2.590 263
KBr disc
nujol mull
