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 9 results

Search term: WXUAQHNMJWJLTG (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
9922

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C5H8O4/c1-3(5(8)9)2-4(6)7/h3H,2H2,1H3,(H,6,7)(H,8,9)
C5H8O4132.114613425239268
5323413

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C5H8O4/c1-3(5(8)9)2-4(6)7/h3H,2H2,1H3,(H,6,7)(H,8,9)/t3-/m0/s1
C5H8O4132.11462815300
70369

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C5H8O4/c1-3(5(8)9)2-4(6)7/h3H,2H2,1H3,(H,6,7)(H,8,9)/t3-/m1/s1
C5H8O4132.1146755501
24532763

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C5H8O4/c1-3(5(8)9)2-4(6)7/h3H,2H2,1H3,(H,6,7)(H,8,9)/i1D3,2D2,3D
C5H2D6O4138.151671100
3932305

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C5H8O4/c1-3(5(8)9)2-4(6)7/h3H,2H2,1H3,(H,6,7)(H,8,9)/p-2
C5H6O4130.09984284579
5323412

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C5H8O4/c1-3(5(8)9)2-4(6)7/h3H,2H2,1H3,(H,6,7)(H,8,9)/p-2/t3-/m0/s1
C5H6O4130.098744429
5323414

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C5H8O4/c1-3(5(8)9)2-4(6)7/h3H,2H2,1H3,(H,6,7)(H,8,9)/p-2/t3-/m1/s1
C5H6O4130.098742200
8900723

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C5H8O4/c1-3(5(8)9)2-4(6)7/h3H,2H2,1H3,(H,6,7)(H,8,9)/i2+1,3+1
C313C2H8O4134.09992100
9380831

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C5H8O4/c1-3(5(8)9)2-4(6)7/h3H,2H2,1H3,(H,6,7)(H,8,9)/i2D,3D
C5H6D2O4134.12692100

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