1,3-DIHYDROXYNAPHTHALENE(132-86-5) IR1
Product Name1,3-DIHYDROXYNAPHTHALENE
CAS132-86-5
Molecular FormulaC10H8O2
Molecular Weight160.17
InChIInChI=1S/C10H8O2/c11-8-5-7-3-1-2-4-9(7)10(12)6-8/h1-6,11-12H
InChIKey XOOMNEFVDUTJPP-UHFFFAOYSA-N
SmilesC1(O)=C2C(C=CC=C2)=CC(O)=C1
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MassMS-NW-0112 1,3-naphthalenediol C10H8O2 (Mass of molecular ion: 160)
Source Temperature: 230 °C Sample Temperature: 0 °C Direct, 75 eV
14.0 2.2 15.0 1.4 26.0 3.6 27.0 9.5 29.0 10.3 37.0 5.5 38.0 12.2 39.0 27.6 40.0 2.5 41.0 3.1 42.0 7.3 43.0 1.9 49.0 3.3 50.0 27.8 51.0 42.4 52.0 9.4 53.0 9.3 54.0 2.1 55.0 3.5 61.0 9.3 62.0 25.1 63.0 45.1 64.0 9.7 65.0 6.6 65.5 1.9 66.0 2.1 69.0 10.8 73.0 3.1 74.0 18.4 75.0 19.0 76.0 18.7 77.0 76.7 78.0 20.7 79.0 2.2 80.0 1.5 85.0 3.9 86.0 8.4 87.0 12.7 88.0 6.2 89.0 25.6 90.0 36.4 91.0 13.8 92.0 2.0 98.0 3.0 99.0 1.3 101.0 5.3 102.0 31.2 103.0 61.6 104.0 22.7 105.0 6.3 110.0 1.1 113.0 5.4 114.0 7.5 115.0 13.0 116.0 1.6 118.0 14.3 119.0 3.0 129.0 1.3 130.0 1.2 131.0 100.0 132.0 35.0 133.0 3.1 142.0 1.0 159.0 2.1 160.0 95.5 161.0 11.1 162.0 1.0
400 MHz in DMSO-d6
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1H NMR 399.65 MHz C10 H8 O2 0.036 g : 0.5 ml DMSO-d6 1,3-naphthalenediol 
Assign. Shift(ppm)
A *1 10.07 B *1 9.48 C 7.982 D 7.561 E 7.329 F 7.170 G 6.618 J 6.546
Hz ppm Int.4027.10 10.077 1000 3790.44 9.485 878 3194.43 7.994 303 3186.04 7.973 316 3026.28 7.573 300 3018.04 7.552 352 2937.47 7.351 155 2936.40 7.348 179 2930.60 7.333 207 2929.53 7.331 307 2928.16 7.327 217 2922.52 7.313 161 2921.30 7.310 179 2873.23 7.190 188 2872.31 7.188 209 2865.30 7.170 298 2864.07 7.167 249 2858.12 7.152 153 2857.21 7.150 162 2646.18 6.622 405 2644.20 6.617 524 2617.34 6.550 564 2615.20 6.544 573
in D2O
in DMSO-d6
KBr disc
