1,4-Naphthalenedicarboxylic acid(605-70-9) 1H NMR
Product Name1,4-Naphthalenedicarboxylic acid
CAS605-70-9
Molecular FormulaC12H8O4
Molecular Weight216.19
InChIInChI=1S/C12H8O4/c13-11(14)9-5-6-10(12(15)16)8-4-2-1-3-7(8)9/h1-6H,(H,13,14)(H,15,16)
InChIKey ABMFBCRYHDZLRD-UHFFFAOYSA-N
SmilesC1(C(O)=O)=C2C(C=CC=C2)=C(C(O)=O)C=C1
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MassMS-IW-7577 1,4-naphthalenedicarboxylic acid C12H8O4 (Mass of molecular ion: 216)
Source Temperature: 160 °C Sample Temperature: 130 °C Direct, 75 eV
18.0 2.3 50.0 1.0 51.0 1.3 57.0 1.3 57.5 1.3 62.0 1.1 63.0 2.9 71.0 2.0 74.0 1.9 75.0 2.4 76.0 1.5 77.0 2.2 85.0 3.0 85.5 1.3 89.0 1.3 99.0 4.5 114.0 1.8 115.0 13.5 116.0 2.4 125.0 3.3 126.0 4.1 127.0 1.8 142.0 1.1 143.0 7.6 144.0 1.3 153.0 3.4 170.0 5.5 171.0 16.1 172.0 2.5 188.0 1.6 198.0 8.0 199.0 37.5 200.0 5.2 215.0 3.6 216.0 100.0 217.0 13.3 218.0 1.6
KBr disc
nujol mull
