• Data source

  • Data source type

  • Focused library

  • XSection

Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 33 results

Search term: DATA_SOURCE in ('PENN-ABS')
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
232041
InChI=1/C9H11NO/c11-9-6-5-7-3-1-2-4-8(7)10-9/h5-6H,1-4H2,(H,10,11)
C9H11NO149.1897846101
255147
InChI=1/C8H9NO/c10-8-5-4-6-2-1-3-7(6)9-8/h4-5H,1-3H2,(H,9,10)
C8H9NO135.1632834900
190859

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C10H12O/c1-2-6-10(11)9-7-4-3-5-8-9/h2-5,7-8,10-11H,1,6H2
C10H12O148.201780193324
672087
InChI=1/C7H7N3S/c8-4-1-2-6-5(3-4)10-7(9)11-6/h1-3H,8H2,(H2,9,10)
C7H7N3S165.2156784900
13360277
InChI=1/C9H8N2O2S/c1-13-8(12)5-2-3-7-6(4-5)11-9(10)14-7/h2-4H,1H3,(H2,10,11)
C9H8N2O2S208.237614400
709110
InChI=1/C9H9N3OS/c1-5(13)11-9-12-7-4-6(10)2-3-8(7)14-9/h2-4H,10H2,1H3,(H,11,12,13)
C9H9N3OS207.2523362700
255151
InChI=1/C10H13NO/c12-10-7-6-8-4-2-1-3-5-9(8)11-10/h6-7H,1-5H2,(H,11,12)
C10H13NO163.2163251900
712862
InChI=1/C9H7N3O3S/c1-5(13)10-9-11-7-4-6(12(14)15)2-3-8(7)16-9/h2-4H,1H3,(H,10,11,13)
C9H7N3O3S237.2352231400
21447276
InChI=1/C11H15NO/c13-11-8-7-9-5-3-1-2-4-6-10(9)12-11/h7-8H,1-6H2,(H,12,13)
C11H15NO177.24299700
21447281

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C16H19N3O5/c1-18-12-8-17-14(21)16(18,15(22)24-3)19(9-12)11-6-4-10(5-7-11)13(20)23-2/h4-7,12H,8-9H2,1-3H3,(H,17,21)
C16H19N3O5333.33925500
21447278

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C15H18ClN3O3/c1-9-6-10(4-5-12(9)16)19-8-11-7-17-13(20)15(19,18(11)2)14(21)22-3/h4-6,11H,7-8H2,1-3H3,(H,17,20)/t11-,15+/m1/s1
C15H18ClN3O3323.77474300
21447279

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C15H16F3N3O3/c1-20-11-7-19-12(22)14(20,13(23)24-2)21(8-11)10-5-3-9(4-6-10)15(16,17)18/h3-6,11H,7-8H2,1-2H3,(H,19,22)/t11-,14+/m1/s1
C15H16F3N3O3343.3014300
15261338

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C9H10BrNO/c10-7-3-1-2-6-4-5-8(12)11-9(6)7/h4-5,7H,1-3H2,(H,11,12)
C9H10BrNO228.08584400
21447259
InChI=1/C10H9N3O2S/c1-5(14)12-10-13-7-4-6(9(11)15)2-3-8(7)16-10/h2-4H,1H3,(H2,11,15)(H,12,13,14)
C10H9N3O2S235.26244300
21447261

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C19H22O5/c1-13(20)11-15(21)12-17(22)19-16-9-6-5-8-14(16)7-3-2-4-10-18(23)24-19/h2-3,5-6,8-9,15,19,21H,4,7,10-12H2,1H3/b3-2-/t15-,19-/m1/s1
C19H22O5330.3754300
21447262

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C19H22O5/c1-13(20)11-15(21)12-17(22)19-16-9-6-5-8-14(16)7-3-2-4-10-18(23)24-19/h2-3,5-6,8-9,15,19,21H,4,7,10-12H2,1H3/b3-2-/t15-,19+/m1/s1
C19H22O5330.3754300
21447264

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H18O/c1-3-5-10-13(14)12-9-7-6-8-11(12)4-2/h4,6-9,13-14H,2-3,5,10H2,1H3
C13H18O190.28143300
21447273

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C10H11NO/c12-9-4-3-8-6-1-2-7(5-6)10(8)11-9/h3-4,6-7H,1-2,5H2,(H,11,12)
C10H11NO161.20043200
21447274

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C10H13NO/c1-7-3-2-4-8-5-6-9(12)11-10(7)8/h5-7H,2-4H2,1H3,(H,11,12)
C10H13NO163.21633200
21447275

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C10H13NO2/c1-13-8-4-2-3-7-5-6-9(12)11-10(7)8/h5-6,8H,2-4H2,1H3,(H,11,12)
C10H13NO2179.21573200
12

Advertisement