Phthalimide(85-41-6) MS
Product NamePhthalimide
CAS85-41-6
Molecular FormulaC8H5NO2
Molecular Weight147.13
InChIInChI=1S/C8H5NO2/c10-7-5-3-1-2-4-6(5)8(11)9-7/h1-4H,(H,9,10,11)
InChIKey XKJCHHZQLQNZHY-UHFFFAOYSA-N
SmilesC1(=O)C2=C(C=CC=C2)C(=O)N1
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MassMS-NW-8828 phthalimide C8H5NO2 (Mass of molecular ion: 147)
Source Temperature: 160 °C Sample Temperature: 100 °C Direct, 75 eV
28.0 1.4 37.0 2.3 38.0 4.1 39.0 1.2 45.5 2.5 49.0 1.3 50.0 21.1 51.0 1.7 52.0 3.2 59.5 2.3 63.0 1.5 64.0 1.2 66.0 4.1 73.0 1.7 74.0 8.6 75.0 8.1 76.0 54.7 77.0 4.1 90.0 1.9 92.0 1.0 103.0 16.1 104.0 57.0 105.0 4.5 147.0 100.0 148.0 9.7
400 MHz in DMSO-d6
90 MHz in DMSO-d6
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1H NMR 399.65 MHz C8 H5 N O2 0.036 g : 0.5 ml DMSO-d6 phthalimide 
Assign. Shift(ppm)
A 11.38 B 7.85
Hz ppm Int.4547.84 11.380 33 3137.46 7.851 1000
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1H NMR 89.56 MHz C8 H5 N O2 0.041 g : 0.5 ml DMSO-d6 phthalimide Assign. Shift(ppm)
A 11.4 B 7.85
Hz ppm Int.703.20 7.852 1000
KBr disc
nujol mull
