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 15 results

Search term: RZGFUGXQKMEMOO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4593697

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H18O4/c13-7-3-1-2-4-10-9(8-12(15)16)5-6-11(10)14/h1-2,9-10,13H,3-8H2,(H,15,16)/b2-1-/t9-,10-/m1/s1
C12H18O4226.2689373100
4947920

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H18O4/c13-7-3-1-2-4-10-9(8-12(15)16)5-6-11(10)14/h1-2,9-10,13H,3-8H2,(H,15,16)/b2-1-/t9-,10+/m1/s1
C12H18O4226.26891820103
9054128

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C12H18O4/c13-7-3-1-2-4-10-9(8-12(15)16)5-6-11(10)14/h1-2,9-10,13H,3-8H2,(H,15,16)/b2-1-
C12H18O4226.2689151800
8013194

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C12H18O4/c13-7-3-1-2-4-10-9(8-12(15)16)5-6-11(10)14/h1-2,9-10,13H,3-8H2,(H,15,16)/b2-1+
C12H18O4226.2689131700
9710723

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C12H18O4/c13-7-3-1-2-4-10-9(8-12(15)16)5-6-11(10)14/h1-2,9-10,13H,3-8H2,(H,15,16)/b2-1-/t9-,10-/m1/s1/i8D2
C12H16D2O4228.28123200
57620084

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H18O4/c13-7-3-1-2-4-10-9(8-12(15)16)5-6-11(10)14/h1-2,9-10,13H,3-8H2,(H,15,16)/b2-1+/t9-,10-/m1/s1
C12H18O4226.26893200
58170227

Charge

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H18O4/c13-7-3-1-2-4-10-9(8-12(15)16)5-6-11(10)14/h1-2,9-10,13H,3-8H2,(H,15,16)/p-1/b2-1-/t9-,10-/m1/s1
C12H17O4225.26153300
76962840

Charge

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H18O4/c13-7-3-1-2-4-10-9(8-12(15)16)5-6-11(10)14/h1-2,9-10,13H,3-8H2,(H,15,16)/p-1/b2-1-/t9-,10+/m1/s1
C12H17O4225.26153400
17220767

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H18O4/c13-7-3-1-2-4-10-9(8-12(15)16)5-6-11(10)14/h1-2,9-10,13H,3-8H2,(H,15,16)/b2-1-/t9-,10+/m0/s1
C12H18O4226.26892200
110426803

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H18O4/c13-7-3-1-2-4-10-9(8-12(15)16)5-6-11(10)14/h1-2,9-10,13H,3-8H2,(H,15,16)/b2-1+/t9-,10+/m1/s1
C12H18O4226.26891100
76962400

Charge

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C12H18O4/c13-7-3-1-2-4-10-9(8-12(15)16)5-6-11(10)14/h1-2,9-10,13H,3-8H2,(H,15,16)/p-1/b2-1-
C12H17O4225.26151200

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