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 13 results

Search term: SZXBQTSZISFIAO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
75516

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C10H19NO4/c1-6(2)7(8(12)13)11-9(14)15-10(3,4)5/h6-7H,1-5H3,(H,11,14)(H,12,13)/t7-/m0/s1
C10H19NO4217.2622136120428
553206

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C10H19NO4/c1-6(2)7(8(12)13)11-9(14)15-10(3,4)5/h6-7H,1-5H3,(H,11,14)(H,12,13)/t7-/m1/s1
C10H19NO4217.26221157900
238053

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C10H19NO4/c1-6(2)7(8(12)13)11-9(14)15-10(3,4)5/h6-7H,1-5H3,(H,11,14)(H,12,13)
C10H19NO4217.262210811301
24532122

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C10H19NO4/c1-6(2)7(8(12)13)11-9(14)15-10(3,4)5/h6-7H,1-5H3,(H,11,14)(H,12,13)/t7-/m0/s1/i1D3,2D3,6D,7D
C10H11D8NO4225.3115151400
17341036

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C10H19NO4/c1-6(2)7(8(12)13)11-9(14)15-10(3,4)5/h6-7H,1-5H3,(H,11,14)(H,12,13)/t7-/m0/s1/i11+1
C10H1915NO4218.2556121600
49071253

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C10H19NO4/c1-6(2)7(8(12)13)11-9(14)15-10(3,4)5/h6-7H,1-5H3,(H,11,14)(H,12,13)/t7-/m0/s1/i8+1
C913CH19NO4218.25484300
57267100

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C10H19NO4/c1-6(2)7(8(12)13)11-9(14)15-10(3,4)5/h6-7H,1-5H3,(H,11,14)(H,12,13)/t7-/m0/s1/i7D
C10H18DNO4218.26834300
8760329

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C10H19NO4/c1-6(2)7(8(12)13)11-9(14)15-10(3,4)5/h6-7H,1-5H3,(H,11,14)(H,12,13)/t7-/m0/s1/i8+2
C914CH19NO4219.25472200
8808132

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C10H19NO4/c1-6(2)7(8(12)13)11-9(14)15-10(3,4)5/h6-7H,1-5H3,(H,11,14)(H,12,13)/t7-/m0/s1/i7+2,8+2
C814C2H19NO4221.24722200
9818992

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C10H19NO4/c1-6(2)7(8(12)13)11-9(14)15-10(3,4)5/h6-7H,1-5H3,(H,11,14)(H,12,13)/t7-/m0/s1/i1+1,2+1,6+1,7+1,8+1,11+1
C513C5H1915NO4223.21882200
1267654

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C10H19NO4/c1-6(2)7(8(12)13)11-9(14)15-10(3,4)5/h6-7H,1-5H3,(H,11,14)(H,12,13)/p-1/t7-/m1/s1
C10H18NO4216.25481100
1415357

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C10H19NO4/c1-6(2)7(8(12)13)11-9(14)15-10(3,4)5/h6-7H,1-5H3,(H,11,14)(H,12,13)/p-1/t7-/m0/s1
C10H18NO4216.25481100

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