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 17 results

Search term: FIRDBEQIJQERSE (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
8047247

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H10F2N2O5/c10-9(11)6(16)4(3-14)18-7(9)13-2-1-5(15)12-8(13)17/h1-2,4,6-7,14,16H,3H2,(H,12,15,17)/t4-,6-,7-/m1/s1
C9H10F2N2O5264.18296311080
31046290

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H10F2N2O5/c10-9(11)6(16)4(3-14)18-7(9)13-2-1-5(15)12-8(13)17/h1-2,4,6-7,14,16H,3H2,(H,12,15,17)/t4-,6+,7+/m1/s1
C9H10F2N2O5264.1829111100
23630222

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H10F2N2O5/c10-9(11)6(16)4(3-14)18-7(9)13-2-1-5(15)12-8(13)17/h1-2,4,6-7,14,16H,3H2,(H,12,15,17)/t4-,6+,7-/m1/s1
C9H10F2N2O5264.18299800
11573692

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C9H10F2N2O5/c10-9(11)6(16)4(3-14)18-7(9)13-2-1-5(15)12-8(13)17/h1-2,4,6-7,14,16H,3H2,(H,12,15,17)
C9H10F2N2O5264.18296900
29789256

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C9H10F2N2O5/c10-9(11)6(16)4(3-14)18-7(9)13-2-1-5(15)12-8(13)17/h1-2,4,6-7,14,16H,3H2,(H,12,15,17)/t4-,6?,7+/m1/s1
C9H10F2N2O5264.18294500
29789257

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C9H10F2N2O5/c10-9(11)6(16)4(3-14)18-7(9)13-2-1-5(15)12-8(13)17/h1-2,4,6-7,14,16H,3H2,(H,12,15,17)/t4-,6?,7-/m1/s1
C9H10F2N2O5264.18294400
76920330

3 of 3 defined stereocentres - 3/3 defined

Non-standard isotope
InChI=1/C9H10F2N2O5/c10-9(11)6(16)4(3-14)18-7(9)13-2-1-5(15)12-8(13)17/h1-2,4,6-7,14,16H,3H2,(H,12,15,17)/t4-,6-,7-/m1/s1/i8+1,12+1,13+1
C813CH10F215N2O5267.16244600
34448783

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C9H10F2N2O5/c10-9(11)6(16)4(3-14)18-7(9)13-2-1-5(15)12-8(13)17/h1-2,4,6-7,14,16H,3H2,(H,12,15,17)/t4-,6-,7?/m1/s1
C9H10F2N2O5264.18293400
415630

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H10F2N2O5/c10-9(11)6(16)4(3-14)18-7(9)13-2-1-5(15)12-8(13)17/h1-2,4,6-7,14,16H,3H2,(H,12,15,17)/t4-,6-,7-/m0/s1
C9H10F2N2O5264.18293200
415636

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H10F2N2O5/c10-9(11)6(16)4(3-14)18-7(9)13-2-1-5(15)12-8(13)17/h1-2,4,6-7,14,16H,3H2,(H,12,15,17)/t4-,6-,7+/m0/s1
C9H10F2N2O5264.18293200
30778583

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H10F2N2O5/c10-9(11)6(16)4(3-14)18-7(9)13-2-1-5(15)12-8(13)17/h1-2,4,6-7,14,16H,3H2,(H,12,15,17)/t4-,6+,7-/m0/s1
C9H10F2N2O5264.18292200
35518672

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H10F2N2O5/c10-9(11)6(16)4(3-14)18-7(9)13-2-1-5(15)12-8(13)17/h1-2,4,6-7,14,16H,3H2,(H,12,15,17)/t4-,6-,7+/m1/s1
C9H10F2N2O5264.18292200
107444699

3 of 3 defined stereocentres - 3/3 defined

Non-standard isotope
InChI=1/C9H10F2N2O5/c10-9(11)6(16)4(3-14)18-7(9)13-2-1-5(15)12-8(13)17/h1-2,4,6-7,14,16H,3H2,(H,12,15,17)/t4-,6-,7-/m1/s1/i2+1,8+1,12+1,13+1
C713C2H10F215N2O5268.1552200
113603414

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H10F2N2O5/c10-9(11)6(16)4(3-14)18-7(9)13-2-1-5(15)12-8(13)17/h1-2,4,6-7,14,16H,3H2,(H,12,15,17)/t4-,6+,7+/m0/s1
C9H10F2N2O5264.18291100
78429294

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C9H10F2N2O5/c10-9(11)6(16)4(3-14)18-7(9)13-2-1-5(15)12-8(13)17/h1-2,4,6-7,14,16H,3H2,(H,12,15,17)/t4?,6?,7-/m1/s1
C9H10F2N2O5264.18291100
58782161

2 of 3 defined stereocentres - 2/3 defined

Non-standard isotope
InChI=1/C9H10F2N2O5/c10-9(11)6(16)4(3-14)18-7(9)13-2-1-5(15)12-8(13)17/h1-2,4,6-7,14,16H,3H2,(H,12,15,17)/t4-,6?,7-/m1/s1/i8+1,12+1,13+1
C813CH10F215N2O5267.16241100
73989970

3 of 3 defined stereocentres - 3/3 defined

Non-standard isotope
InChI=1/C9H10F2N2O5/c10-9(11)6(16)4(3-14)18-7(9)13-2-1-5(15)12-8(13)17/h1-2,4,6-7,14,16H,3H2,(H,12,15,17)/t4-,6-,7-/m1/s1/i7+1,12+1,13+1
C813CH10F215N2O5267.16241100

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