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 40 results

Search term: KDXKERNSBIXSRK (Found by InChIKey (skeleton match))
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
5747


1 of 1 defined stereocentres - 1/1 defined
InChI=1/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/t5-/m0/s1
C6H14N2O2146.1876169873440104468
843

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)
C6H14N2O2146.187614621112435514489
51793

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/t5-/m1/s1
C6H14N2O2146.187611598621135
556872

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/p+1/t5-/m0/s1
C6H15N2O2147.195111200
118538

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/t5-/m0/s1/i1T,2T/t1?,2?,5-
C6H12T2N2O2150.203810800
27472549

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/t5-/m0/s1/i6+2
C514CH14N2O2148.18019800
17345093

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/t5-/m0/s1/i8+1
C6H14N15NO2147.18151100
17341139

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/i1D2,2D2
C6H10D4N2O2150.21224400
4574337

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/p-1/t5-/m0/s1
C6H13N2O2145.18024500
9150839

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/t5-/m0/s1/i4+1
C513CH14N2O2147.18024400
2771146

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/p+1
C6H15N2O2147.19554700
4574331

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/p-1
C6H13N2O2145.180241400
4574333

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/p+1/t5-/m1/s1
C6H15N2O2147.1953300
17341137

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/i1D2,2D2,3D2,4D2
C6H6D8N2O2154.23693300
8466339

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/i8+1
C6H14N15NO2147.1813400
8488678

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/i5+1
C513CH14N2O2147.18022100
4574334

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/p-1/t5-/m1/s1
C6H13N2O2145.18022200
4574335

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/p+2/t5-/m0/s1
C6H16N2O2148.20232200
4574332

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/p+2/t5-/m1/s1
C6H16N2O2148.20232200
4425116

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/p+2
C6H16N2O2148.203442200
12

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