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 8 results

Search term: HNSUDSIHCJEYQG (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
397599

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H12FN3O3/c10-5-3-8(16-6(5)4-14)13-2-1-7(11)12-9(13)15/h1-2,5-6,8,14H,3-4H2,(H2,11,12,15)/t5-,6+,8+/m0/s1
C9H12FN3O3229.2083221700
316041

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C9H12FN3O3/c10-5-3-8(16-6(5)4-14)13-2-1-7(11)12-9(13)15/h1-2,5-6,8,14H,3-4H2,(H2,11,12,15)
C9H12FN3O3229.20836500
398161

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H12FN3O3/c10-5-3-8(16-6(5)4-14)13-2-1-7(11)12-9(13)15/h1-2,5-6,8,14H,3-4H2,(H2,11,12,15)/t5-,6-,8-/m0/s1
C9H12FN3O3229.20835500
422059

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H12FN3O3/c10-5-3-8(16-6(5)4-14)13-2-1-7(11)12-9(13)15/h1-2,5-6,8,14H,3-4H2,(H2,11,12,15)/t5-,6+,8+/m1/s1
C9H12FN3O3229.20834400
8258061

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H12FN3O3/c10-5-3-8(16-6(5)4-14)13-2-1-7(11)12-9(13)15/h1-2,5-6,8,14H,3-4H2,(H2,11,12,15)/t5-,6-,8+/m0/s1
C9H12FN3O3229.20832100
20005699

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C9H12FN3O3/c10-5-3-8(16-6(5)4-14)13-2-1-7(11)12-9(13)15/h1-2,5-6,8,14H,3-4H2,(H2,11,12,15)/t5?,6-,8-/m1/s1
C9H12FN3O3229.20832220
23147320

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C9H12FN3O3/c10-5-3-8(16-6(5)4-14)13-2-1-7(11)12-9(13)15/h1-2,5-6,8,14H,3-4H2,(H2,11,12,15)/t5-,6-,8?/m1/s1
C9H12FN3O3229.20832200
114394428

3 of 3 defined stereocentres - 3/3 defined

Non-standard isotope
InChI=1/C9H12FN3O3/c10-5-3-8(16-6(5)4-14)13-2-1-7(11)12-9(13)15/h1-2,5-6,8,14H,3-4H2,(H2,11,12,15)/t5-,6+,8+/m0/s1/i1T,2T
C9H10T2FN3O3233.22451100

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