1-Naphthaleneethanol(773-99-9) MS
Product Name1-Naphthaleneethanol
CAS773-99-9
Molecular FormulaC12H12O
Molecular Weight172.22
InChIInChI=1S/C12H12O/c13-9-8-11-6-3-5-10-4-1-2-7-12(10)11/h1-7,13H,8-9H2
InChIKey RXWNCMHRJCOWDK-UHFFFAOYSA-N
SmilesC1(CCO)=C2C(C=CC=C2)=CC=C1
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MassMS-NW-6760 1-naphthaleneethanol C12H12O (Mass of molecular ion: 172)
Source Temperature: 200 °C Sample Temperature: 190 °C Reservoir, 75 eV
18.0 1.1 31.0 1.9 39.0 1.9 50.0 1.3 51.0 2.0 62.0 1.2 63.0 3.5 65.0 1.1 74.0 1.2 75.0 1.6 76.0 1.8 77.0 1.1 87.0 1.0 89.0 1.9 91.0 1.0 115.0 19.6 116.0 2.1 126.0 1.1 127.0 1.6 128.0 4.0 129.0 1.1 139.0 6.4 140.0 2.0 141.0 100.0 142.0 26.1 143.0 2.7 152.0 2.6 153.0 3.3 154.0 2.3 172.0 34.8 173.0 4.9
400 MHz in CDCl3
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1H NMR 399.65 MHz C12 H12 O 0.040 g : 0.5 ml CDCl3 1-naphthaleneethanol 
Assign. Shift(ppm)
A 8.011 B 7.824 C 7.712 D *1 7.48 E *1 7.46 F 7.374 G 7.325 J 3.903 K 3.282 L 1.87
Hz ppm Int.3205.93 8.022 241 3204.71 8.019 271 3197.88 8.002 228 3196.90 8.000 286 3132.45 7.838 271 3130.13 7.833 186 3124.88 7.820 355 3122.92 7.815 294 3086.67 7.724 294 3082.52 7.714 33 3078.49 7.703 325 3000.73 7.509 126 2999.02 7.505 159 2993.90 7.492 344 2992.31 7.488 310 2990.84 7.484 152 2986.33 7.473 548 2984.62 7.469 486 2979.86 7.457 165 2978.76 7.454 292 2977.42 7.451 317 2971.92 7.437 134 2970.58 7.433 108 2955.57 7.396 275 2948.49 7.378 486 2944.46 7.368 30 2943.85 7.367 30 2940.43 7.358 458 2930.79 7.334 386 2929.44 7.331 408 2923.83 7.316 215 2922.49 7.313 197 1566.77 3.921 498 1559.94 3.904 1000 1553.22 3.887 530 1318.24 3.299 501 1311.40 3.282 921 1304.69 3.265 452 747.92 1.872 195
KBr disc
nujol mull
