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
Additional Filters

Found 38 results

Search term: XJNKZTHFPGIJNS (Found by InChIKey (skeleton match))
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2016967

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C9H16O6/c1-2-3-14-9-8(13)7(12)6(11)5(4-10)15-9/h2,5-13H,1,3-4H2/t5-,6+,7+,8-,9+/m1/s1
C9H16O6220.21974734800
9053935

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C9H16O6/c1-2-3-14-9-8(13)7(12)6(11)5(4-10)15-9/h2,5-13H,1,3-4H2/t5-,6-,7+,8-,9+/m1/s1
C9H16O6220.2197594000
9195578

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C9H16O6/c1-2-3-14-9-8(13)7(12)6(11)5(4-10)15-9/h2,5-13H,1,3-4H2/t5-,6+,7+,8-,9-/m1/s1
C9H16O6220.2197523600
9910845

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C9H16O6/c1-2-3-14-9-8(13)7(12)6(11)5(4-10)15-9/h2,5-13H,1,3-4H2/t5-,6-,7+,8-,9-/m1/s1
C9H16O6220.2197332400
9358682

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C9H16O6/c1-2-3-14-9-8(13)7(12)6(11)5(4-10)15-9/h2,5-13H,1,3-4H2/t5-,6-,7+,8+,9+/m1/s1
C9H16O6220.2197302500
133118

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C9H16O6/c1-2-3-14-9-8(13)7(12)6(11)5(4-10)15-9/h2,5-13H,1,3-4H2/t5-,6+,7+,8-,9?/m1/s1
C9H16O6220.21979712
306955

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C9H16O6/c1-2-3-14-9-8(13)7(12)6(11)5(4-10)15-9/h2,5-13H,1,3-4H2
C9H16O6220.219791200
10363122

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C9H16O6/c1-2-3-14-9-8(13)7(12)6(11)5(4-10)15-9/h2,5-13H,1,3-4H2/t5-,6+,7+,8-,9+/m0/s1
C9H16O6220.21976400
9086321

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C9H16O6/c1-2-3-14-9-8(13)7(12)6(11)5(4-10)15-9/h2,5-13H,1,3-4H2/t5-,6-,7+,8-,9?/m1/s1
C9H16O6220.21975300
23977384

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C9H16O6/c1-2-3-14-9-8(13)7(12)6(11)5(4-10)15-9/h2,5-13H,1,3-4H2/t5?,6-,7-,8?,9-/m0/s1
C9H16O6220.21974300
60497942

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C9H16O6/c1-2-3-14-9-8(13)7(12)6(11)5(4-10)15-9/h2,5-13H,1,3-4H2/t5?,6-,7+,8?,9+/m0/s1
C9H16O6220.21974300
62479784

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C9H16O6/c1-2-3-14-9-8(13)7(12)6(11)5(4-10)15-9/h2,5-13H,1,3-4H2/t5-,6+,7-,8-,9+/m1/s1
C9H16O6220.21974400
60497943

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C9H16O6/c1-2-3-14-9-8(13)7(12)6(11)5(4-10)15-9/h2,5-13H,1,3-4H2/t5?,6-,7-,8?,9-/m1/s1
C9H16O6220.21973200
29782134

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C9H16O6/c1-2-3-14-9-8(13)7(12)6(11)5(4-10)15-9/h2,5-13H,1,3-4H2/t5-,6+,7+,8-,9?/m0/s1
C9H16O6220.21973200
60497940

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C9H16O6/c1-2-3-14-9-8(13)7(12)6(11)5(4-10)15-9/h2,5-13H,1,3-4H2/t5?,6-,7+,8?,9-/m0/s1
C9H16O6220.21973200
60497941

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C9H16O6/c1-2-3-14-9-8(13)7(12)6(11)5(4-10)15-9/h2,5-13H,1,3-4H2/t5?,6-,7-,8?,9+/m1/s1
C9H16O6220.21973200
62479770

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C9H16O6/c1-2-3-14-9-8(13)7(12)6(11)5(4-10)15-9/h2,5-13H,1,3-4H2/t5-,6-,7-,8+,9+/m1/s1
C9H16O6220.21972200
62654925

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C9H16O6/c1-2-3-14-9-8(13)7(12)6(11)5(4-10)15-9/h2,5-13H,1,3-4H2/t5-,6-,7+,8-,9-/m0/s1
C9H16O6220.21972200
29408904

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C9H16O6/c1-2-3-14-9-8(13)7(12)6(11)5(4-10)15-9/h2,5-13H,1,3-4H2/t5-,6+,7-,8-,9+/m0/s1
C9H16O6220.21972200
29408989

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C9H16O6/c1-2-3-14-9-8(13)7(12)6(11)5(4-10)15-9/h2,5-13H,1,3-4H2/t5-,6+,7-,8+,9-/m0/s1
C9H16O6220.21972200
12

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