Product NameCitric acid
CAS77-92-9
Molecular FormulaC6H8O7
Molecular Weight192.12
InChIInChI=1S/C6H8O7/c7-3(8)1-6(13,5(11)12)2-4(9)10/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
InChIKey KRKNYBCHXYNGOX-UHFFFAOYSA-N
SmilesC(C(O)=O)C(O)(C(O)=O)CC(O)=O
MS
1HNMR
13CNMR
IR1
Raman
Assign. Shift(ppm) A *1 2.757 B *1 2.662
ppm Int. Assign. 174.37 160 1 171.10 1000 2 72.42 298 3 42.61 677 4
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