DL-Mandelic acid(611-72-3) MS
Product NameDL-Mandelic acid
CAS611-72-3
Molecular FormulaC8H8O3
Molecular Weight152.15
InChIInChI=1S/C8H8O3/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5,7,9H,(H,10,11)
InChIKey IWYDHOAUDWTVEP-UHFFFAOYSA-N
SmilesC1(C=CC=CC=1)C(O)C(=O)O
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MassMS-IW-2663 DL-mandelic acid C8H8O3 (Mass of molecular ion: 152)
Source Temperature: 120 °C Sample Temperature: 90 °C Direct, 75 eV
18.0 4.1 27.0 1.1 28.0 1.1 29.0 1.5 39.0 2.3 45.0 1.0 50.0 3.3 51.0 8.2 52.0 1.9 53.0 1.7 63.0 1.5 74.0 1.0 77.0 28.7 78.0 4.5 79.0 45.2 80.0 3.1 89.0 1.5 90.0 3.0 105.0 4.9 106.0 1.6 107.0 100.0 108.0 8.6 152.0 19.3 153.0 1.7
KBr disc
nujol mull
4880 A,200 M,powder
