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 16 results

Search term: AELCINSCMGFISI (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
18369

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C9H11N/c10-9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6,10H2/t8-,9+/m0/s1
C9H11N133.190388124119114
5329

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C9H11N/c10-9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6,10H2
C9H11N133.19038498110
24284

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C9H11N/c10-9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6,10H2/t8-,9+/m1/s1
C9H11N133.1903604900
390008

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C9H11N/c10-9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6,10H2/t8?,9-/m1/s1
C9H11N133.19033128117748
5341993

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C9H11N/c10-9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6,10H2/t8-,9-/m1/s1
C9H11N133.1903262800
5036596

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C9H11N/c10-9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6,10H2/t8-,9-/m0/s1
C9H11N133.1903151300
4642502

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C9H11N/c10-9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6,10H2/t8-,9?/m0/s1
C9H11N133.19038800
395459

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C9H11N/c10-9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6,10H2/p+1/t8-,9+/m1/s1
C9H12N134.19776600
10036445

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C9H11N/c10-9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6,10H2/p+1/t8-,9+/m0/s1
C9H12N134.19774300
390109

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C9H11N/c10-9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6,10H2/t8?,9-/m0/s1
C9H11N133.19033200
2627899

Charge

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C9H11N/c10-9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6,10H2/p+1
C9H12N134.198281100
67152818

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C9H11N/c10-9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6,10H2/t8-,9+/m0/s1/i6D2
C9H9D2N135.20271100
78361987

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C9H11N/c10-9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6,10H2/t8-,9+/m0/s1/i1D,2D,3D,4D,5D
C9H6D5N138.22121100
114392689

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C9H11N/c10-9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6,10H2/t8-,9+/m1/s1/i1D,2D,3D,4D,5D
C9H6D5N138.22121100
114392690

1 of 2 defined stereocentres - 1/2 defined

Non-standard isotope
InChI=1/C9H11N/c10-9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6,10H2/t8?,9-/m0/s1/i1D,2D,3D,4D,5D
C9H6D5N138.22121100

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