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 8 results

Search term: YDGMGEXADBMOMJ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
110375

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C8H18N4O2/c1-12(2)8(10)11-5-3-4-6(9)7(13)14/h6H,3-5,9H2,1-2H3,(H2,10,11)(H,13,14)/t6-/m0/s1
C8H18N4O2202.2541717700
487

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C8H18N4O2/c1-12(2)8(10)11-5-3-4-6(9)7(13)14/h6H,3-5,9H2,1-2H3,(H2,10,11)(H,13,14)
C8H18N4O2202.2541204300
16743930

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C8H18N4O2/c1-12(2)8(10)11-5-3-4-6(9)7(13)14/h6H,3-5,9H2,1-2H3,(H2,10,11)(H,13,14)/t6-/m1/s1
C8H18N4O2202.2541191600
21232689

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C8H18N4O2/c1-12(2)8(10)11-5-3-4-6(9)7(13)14/h6H,3-5,9H2,1-2H3,(H2,10,11)(H,13,14)/p+1/t6-/m0/s1
C8H19N4O2203.26152100
57558880

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C8H18N4O2/c1-12(2)8(10)11-5-3-4-6(9)7(13)14/h6H,3-5,9H2,1-2H3,(H2,10,11)(H,13,14)/t6-/m0/s1/i1D3,2D3
C8H12D6N4O2208.29112200
107437118

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C8H18N4O2/c1-12(2)8(10)11-5-3-4-6(9)7(13)14/h6H,3-5,9H2,1-2H3,(H2,10,11)(H,13,14)/i3+1,4+1,5+1,6+1,7+1
C313C5H18N4O2207.21742200
107447541

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C8H18N4O2/c1-12(2)8(10)11-5-3-4-6(9)7(13)14/h6H,3-5,9H2,1-2H3,(H2,10,11)(H,13,14)/t6-/m0/s1/i3D2,4D2,5D2
C8H12D6N4O2208.29111100
111314038

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C8H18N4O2/c1-12(2)8(10)11-5-3-4-6(9)7(13)14/h6H,3-5,9H2,1-2H3,(H2,10,11)(H,13,14)/t6-/m1/s1/i3D2,4D2,5D2
C8H12D6N4O2208.29111100

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