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: TWXDDNPPQUTEOV (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
59512


1 of 1 defined stereocentres - 1/1 defined
InChI=1/C10H15N.ClH/c1-9(11-2)8-10-6-4-3-5-7-10;/h3-7,9,11H,8H2,1-2H3;1H/t9-;/m0./s1
C10H16ClN185.69374280408920041
8947

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C10H15N.ClH/c1-9(11-2)8-10-6-4-3-5-7-10;/h3-7,9,11H,8H2,1-2H3;1H
C10H16ClN185.6937440137234
19969600

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C10H15N.ClH/c1-9(11-2)8-10-6-4-3-5-7-10;/h3-7,9,11H,8H2,1-2H3;1H/t9-;/m1./s1
C10H16ClN185.69371924027
24533229

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C10H15N.ClH/c1-9(11-2)8-10-6-4-3-5-7-10;/h3-7,9,11H,8H2,1-2H3;1H/i1D3,2D3,8D2,9D;
C10H7D9ClN194.749291200
32679141

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C10H15N.ClH/c1-9(11-2)8-10-6-4-3-5-7-10;/h3-7,9,11H,8H2,1-2H3;1H/i1D3,2D3,3D,4D,5D,6D,7D,8D2,9D;
C10H2D14ClN199.7871400
45743354

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C10H15N.ClH/c1-9(11-2)8-10-6-4-3-5-7-10;/h3-7,9,11H,8H2,1-2H3;1H/i3D,4D,5D,6D,7D;
C10H11D5ClN190.72467400
49070797

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C10H15N.ClH/c1-9(11-2)8-10-6-4-3-5-7-10;/h3-7,9,11H,8H2,1-2H3;1H/i2D3,8D,9D;
C10H11D5ClN190.724661100
24533228

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C10H15N.ClH/c1-9(11-2)8-10-6-4-3-5-7-10;/h3-7,9,11H,8H2,1-2H3;1H/i1D3,8D2,9D;
C10H10D6ClN191.73076500
48061553

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C10H15N.ClH/c1-9(11-2)8-10-6-4-3-5-7-10;/h3-7,9,11H,8H2,1-2H3;1H/i2D3;
C10H13D3ClN188.71224300
58784149

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C10H15N.ClH/c1-9(11-2)8-10-6-4-3-5-7-10;/h3-7,9,11H,8H2,1-2H3;1H/t9-;/m1./s1/i2D3;
C10H13D3ClN188.71223400
58783753

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C10H15N.ClH/c1-9(11-2)8-10-6-4-3-5-7-10;/h3-7,9,11H,8H2,1-2H3;1H/t9-;/m0./s1/i2D3;
C10H13D3ClN188.71222400
32679140

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C10H15N.ClH/c1-9(11-2)8-10-6-4-3-5-7-10;/h3-7,9,11H,8H2,1-2H3;1H/i1D3,2D3,3D,4D,5D,6D,7D;
C10H5D11ClN196.76152500
107438215

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C10H15N.ClH/c1-9(11-2)8-10-6-4-3-5-7-10;/h3-7,9,11H,8H2,1-2H3;1H/i3+1,4+1,5+1,6+1,7+1,10+1;
C413C6H16ClN191.64971100

Advertisement