Matches any text strings used to describe a molecule.
Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
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Found 32 results

Search term: POORJMIIHXHXAV (Found by InChIKey (skeleton match))
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2005831

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H20O6/c1-11(2)15-7-6(5-13)14-10-9(8(7)16-11)17-12(3,4)18-10/h6-10,13H,5H2,1-4H3/t6-,7+,8+,9-,10-/m1/s1
C12H20O6260.28365946137
18825

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C12H20O6/c1-11(2)15-7-6(5-13)14-10-9(8(7)16-11)17-12(3,4)18-10/h6-10,13H,5H2,1-4H3
C12H20O6260.2836241700
9131508

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C12H20O6/c1-11(2)15-7-6(5-13)14-10-9(8(7)16-11)17-12(3,4)18-10/h6-10,13H,5H2,1-4H3/t6-,7+,8+,9-,10?/m1/s1
C12H20O6260.2836121000
9833690

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H20O6/c1-11(2)15-7-6(5-13)14-10-9(8(7)16-11)17-12(3,4)18-10/h6-10,13H,5H2,1-4H3/t6-,7+,8+,9-,10-/m0/s1
C12H20O6260.283610900
21436153

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C12H20O6/c1-11(2)15-7-6(5-13)14-10-9(8(7)16-11)17-12(3,4)18-10/h6-10,13H,5H2,1-4H3/t6?,7-,8+,9?,10+/m0/s1
C12H20O6260.28365400
17207384

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C12H20O6/c1-11(2)15-7-6(5-13)14-10-9(8(7)16-11)17-12(3,4)18-10/h6-10,13H,5H2,1-4H3/t6?,7-,8-,9+,10+/m0/s1
C12H20O6260.28364200
5414309

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H20O6/c1-11(2)15-7-6(5-13)14-10-9(8(7)16-11)17-12(3,4)18-10/h6-10,13H,5H2,1-4H3/t6-,7+,8-,9-,10-/m1/s1
C12H20O6260.28364300
5413784

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H20O6/c1-11(2)15-7-6(5-13)14-10-9(8(7)16-11)17-12(3,4)18-10/h6-10,13H,5H2,1-4H3/t6-,7-,8+,9-,10+/m1/s1
C12H20O6260.28363300
9229551

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H20O6/c1-11(2)15-7-6(5-13)14-10-9(8(7)16-11)17-12(3,4)18-10/h6-10,13H,5H2,1-4H3/t6-,7-,8+,9-,10-/m1/s1
C12H20O6260.28363200
62300138

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H20O6/c1-11(2)15-7-6(5-13)14-10-9(8(7)16-11)17-12(3,4)18-10/h6-10,13H,5H2,1-4H3/t6-,7+,8+,9+,10+/m1/s1
C12H20O6260.28363300
58783609

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C12H20O6/c1-11(2)15-7-6(5-13)14-10-9(8(7)16-11)17-12(3,4)18-10/h6-10,13H,5H2,1-4H3/t6?,7-,8-,9?,10+/m0/s1
C12H20O6260.28362200
28409265

2 of 5 defined stereocentres - 2/5 defined
InChI=1/C12H20O6/c1-11(2)15-7-6(5-13)14-10-9(8(7)16-11)17-12(3,4)18-10/h6-10,13H,5H2,1-4H3/t6?,7-,8?,9?,10+/m0/s1
C12H20O6260.28362200
9667430

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C12H20O6/c1-11(2)15-7-6(5-13)14-10-9(8(7)16-11)17-12(3,4)18-10/h6-10,13H,5H2,1-4H3/t6-,7+,8?,9-,10-/m1/s1
C12H20O6260.28362100
8598187

5 of 5 defined stereocentres - 5/5 defined

Non-standard isotope
InChI=1/C12H20O6/c1-11(2)15-7-6(5-13)14-10-9(8(7)16-11)17-12(3,4)18-10/h6-10,13H,5H2,1-4H3/t6-,7+,8+,9-,10-/m1/s1/i5D/t5-,6-,7+,8+,9-,10-
C12H19DO6261.28982100
9120397

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H20O6/c1-11(2)15-7-6(5-13)14-10-9(8(7)16-11)17-12(3,4)18-10/h6-10,13H,5H2,1-4H3/t6-,7-,8-,9+,10+/m1/s1
C12H20O6260.28362100
10043439

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H20O6/c1-11(2)15-7-6(5-13)14-10-9(8(7)16-11)17-12(3,4)18-10/h6-10,13H,5H2,1-4H3/t6-,7+,8+,9+,10-/m0/s1
C12H20O6260.28362100
10043440

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H20O6/c1-11(2)15-7-6(5-13)14-10-9(8(7)16-11)17-12(3,4)18-10/h6-10,13H,5H2,1-4H3/t6-,7-,8+,9+,10-/m0/s1
C12H20O6260.28362100
10043441

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H20O6/c1-11(2)15-7-6(5-13)14-10-9(8(7)16-11)17-12(3,4)18-10/h6-10,13H,5H2,1-4H3/t6-,7-,8-,9-,10+/m1/s1
C12H20O6260.28362100
10043442

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H20O6/c1-11(2)15-7-6(5-13)14-10-9(8(7)16-11)17-12(3,4)18-10/h6-10,13H,5H2,1-4H3/t6-,7+,8-,9-,10+/m1/s1
C12H20O6260.28362100
57426729

2 of 5 defined stereocentres - 2/5 defined
InChI=1/C12H20O6/c1-11(2)15-7-6(5-13)14-10-9(8(7)16-11)17-12(3,4)18-10/h6-10,13H,5H2,1-4H3/t6?,7-,8?,9?,10+/m1/s1
C12H20O6260.28361100
12

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