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 20 results

Search term: ODBLHEXUDAPZAU (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
1161

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C6H8O7/c7-3(8)1-2(5(10)11)4(9)6(12)13/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13)
C6H8O7192.1235694518052
4477081

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C6H8O7/c7-3(8)1-2(5(10)11)4(9)6(12)13/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13)/t2-,4+/m0/s1
C6H8O7192.1235277800
394789

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C6H8O7/c7-3(8)1-2(5(10)11)4(9)6(12)13/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13)/t2-,4-/m0/s1
C6H8O7192.1235151400
389359

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C6H8O7/c7-3(8)1-2(5(10)11)4(9)6(12)13/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13)/t2-,4+/m1/s1
C6H8O7192.1235121400
388375

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C6H8O7/c7-3(8)1-2(5(10)11)4(9)6(12)13/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13)/t2-,4-/m1/s1
C6H8O7192.123511900
4573809

Charge

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C6H8O7/c7-3(8)1-2(5(10)11)4(9)6(12)13/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13)/p-3
C6H5O7189.1013724453917115
4573553

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C6H8O7/c7-3(8)1-2(5(10)11)4(9)6(12)13/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13)/p-3/t2-,4+/m0/s1
C6H5O7189.10136500
5341905

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C6H8O7/c7-3(8)1-2(5(10)11)4(9)6(12)13/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13)/p-3/t2-,4-/m0/s1
C6H5O7189.10133200
8188392

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C6H8O7/c7-3(8)1-2(5(10)11)4(9)6(12)13/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13)/t2-,4+/m0/s1/i3+1
C513CH8O7193.11622200
8417174

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C6H8O7/c7-3(8)1-2(5(10)11)4(9)6(12)13/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13)/t2-,4+/m0/s1/i6+1
C513CH8O7193.11622100
8505689

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C6H8O7/c7-3(8)1-2(5(10)11)4(9)6(12)13/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13)/t2-,4+/m0/s1/i1+1
C513CH8O7193.11622100
8550843

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C6H8O7/c7-3(8)1-2(5(10)11)4(9)6(12)13/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13)/t2-,4+/m0/s1/i1+1,3+1,6+1
C313C3H8O7195.10152100
21865261

Charge

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C6H8O7/c7-3(8)1-2(5(10)11)4(9)6(12)13/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13)/p-1
C6H7O7191.11612200
107438950

0 of 2 defined stereocentres - 0/2 defined

Non-standard isotope
InChI=1/C6H8O7/c7-3(8)1-2(5(10)11)4(9)6(12)13/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13)/i1+1,2+1,3+1,5+1
C213C4H8O7196.09412200
4574418

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C6H8O7/c7-3(8)1-2(5(10)11)4(9)6(12)13/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13)/p-3/t2-,4-/m1/s1
C6H5O7189.10132200
4574419

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C6H8O7/c7-3(8)1-2(5(10)11)4(9)6(12)13/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13)/p-3/t2-,4+/m1/s1
C6H5O7189.10132200
67168167

0 of 2 defined stereocentres - 0/2 defined

Non-standard isotope
InChI=1/C6H8O7/c7-3(8)1-2(5(10)11)4(9)6(12)13/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13)/i/hD
C6H7DO7193.12971100
78442099

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C6H8O7/c7-3(8)1-2(5(10)11)4(9)6(12)13/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13)/t2-,4?/m0/s1
C6H8O7192.12351100
20171329

Charge

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C6H8O7/c7-3(8)1-2(5(10)11)4(9)6(12)13/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13)/p-2
C6H6O7190.10871100

Advertisement