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: WHBMMWSBFZVSSR (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
428


0 of 1 defined stereocentres - 0/1 defined
InChI=1/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)
C4H8O3104.1045136793697180
83181

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)/t3-/m1/s1
C4H8O3104.104510215002
85121

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)/t3-/m0/s1
C4H8O3104.10451008802
2779512

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)/p-1
C4H7O3103.0965893442355477
5342123

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)/p-1/t3-/m0/s1
C4H7O3103.097171200
5341936

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)/p-1/t3-/m1/s1
C4H7O3103.097164500
58784417

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)/t3-/m1/s1/i4+1
C313CH8O3105.09724600
8255887

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)/i3D
C4H7DO3105.11072100
17341128

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)/i3+1,4+1
C213C2H8O3106.08981100
17341263

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)/i1+1,2+1
C213C2H8O3106.08981100
17341266

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)/i1+1
C313CH8O3105.09721100
26581089

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)/t3-/m1/s1/i1+1
C313CH8O3105.09721200
26581097

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)/t3-/m1/s1/i1+1D,2D/t2-,3+/m0
C313CH6D2O3107.10951200
26581098

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)/t3-/m1/s1/i1D,2D/t2-,3+/m0
C4H6D2O3106.11681100
116084251

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)/t3-/m1/s1/i4-1
C311CH8O3103.10531100

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