• Data source

  • Data source type

  • Focused library

  • XSection

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

Found 407 results

Search term: DATA_SOURCE in ('dashtemp')
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
1906


InChI=1/C8H9NO2/c1-6(10)9-7-2-4-8(11)5-3-7/h2-5,11H,1H3,(H,9,10)
C8H9NO2151.1626222957614533517
312357
InChI=1/C10H8N2/c11-6-5-8-7-12-10-4-2-1-3-9(8)10/h1-4,7,12H,5H2
C10H8N2156.18391712138730
64075

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C8H15NO3/c1-5(2)4-7(8(11)12)9-6(3)10/h5,7H,4H2,1-3H3,(H,9,10)(H,11,12)/t7-/m0/s1
C8H15NO3173.2096151192891
512092

InChI=1/C10H9NO2/c1-13-10(12)8-6-11-9-5-3-2-4-7(8)9/h2-6,11H,1H3
C10H9NO2175.1841451141757
10442445


0 of 1 defined stereocentres - 0/1 defined
InChI=1/C19H16O4/c1-12(20)11-15(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-16(14)23-19(17)22/h2-10,15,21H,11H2,1H3
C19H16O4308.3279130767712909143
3924


InChI=1/C9H18N2O4/c1-3-4-9(2,5-14-7(10)12)6-15-8(11)13/h3-6H2,1-2H3,(H2,10,12)(H2,11,13)
C9H18N2O4218.25029019221336116
10481896

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C6H6Cl6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-6H/t1-,2-,3-,4+,5+,6+
C6H6Cl6290.8298821901999628
10248513

InChI=1/C16H14ClN3O/c1-18-15-10-20(21)16(11-5-3-2-4-6-11)13-9-12(17)7-8-14(13)19-15/h2-9H,10H2,1H3,(H,18,19)
C16H14ClN3O299.7549812403275856
9400674

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C27H41NO5S/c1-16-9-8-10-17(2)25(31)19(4)26(32)27(6,7)23(29)14-24(30)33-22(12-11-16)18(3)13-21-15-34-20(5)28-21/h11,13,15,17,19,22-23,25,29,31H,8-10,12,14H2,1-7H3/b16-11-,18-13+/t17-,19+,22-,23-,25-/m0/s1
C27H41NO5S491.683160633819
5293755

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C26H37NO3/c1-18(2)26(29)30-25-13-12-21(17-28)16-24(25)23(22-10-8-7-9-11-22)14-15-27(19(3)4)20(5)6/h7-13,16,18-20,23,28H,14-15,17H2,1-6H3/t23-/m1/s1
C26H37NO3411.57695568770
9111216

Charge
InChI=1/C9H16FN2.F6P/c10-9(11-5-1-2-6-11)12-7-3-4-8-12;1-7(2,3,4,5)6/h1-8H2;/q+1;-1
C9H16F7N2P316.1993234525800
5254017


Charge
InChI=1/Mg.O/q+2;-2
MgO40.30443918594491689
22901018

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C43H65N5O10S/c1-10-27(6)38(46-40(53)34-13-11-12-18-47(34)9)42(54)48(24-57-37(51)19-25(2)3)35(26(4)5)22-36(58-29(8)49)41-45-33(23-59-41)39(52)44-31(20-28(7)43(55)56)21-30-14-16-32(50)17-15-30/h14-17,23,25-28,31,34-36,38,50H,10-13,18-22,24H2,1-9H3,(H,44,52)(H,46,53)(H,55,56)/t27-,28-,31+,34+,35+,36+,38-/m0/s1
C43H65N5O10S844.0687394000
454261
InChI=1/C9H16NO2/c1-8(2)5-7(11)6-9(3,4)10(8)12/h5-6H2,1-4H3
C9H16NO2170.2288386562
10669188
InChI=1/C32H52Br2S2/c1-3-5-7-9-11-13-15-17-19-21-23-27-25-29(35-31(27)33)30-26-28(32(34)36-30)24-22-20-18-16-14-12-10-8-6-4-2/h25-26H,3-24H2,1-2H3
C32H52Br2S2660.6933373300
5293174

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H27NO4S/c1-11(10-22-15(21)16(2,3)4)14(20)17(9-13(18)19)12-7-5-6-8-12/h11-12H,5-10H2,1-4H3,(H,18,19)/t11-/m1/s1
C16H27NO4S329.4549363800
9922982

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C12H18O8/c1-6(13)17-5-10-12(19-8(3)15)9(18-7(2)14)4-11(16)20-10/h9-12,16H,4-5H2,1-3H3/t9-,10-,11?,12+/m1/s1
C12H18O8290.2665352900
10321604
InChI=1/C6H3F3O2S/c7-4-1-2-5(8)6(3-4)12(9,10)11/h1-3H
C6H3F3O2S196.147242200
9150700

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C6H8O3/c7-5-2-1-4-3-8-6(5)9-4/h4,6H,1-3H2/t4-,6+/m0/s1
C6H8O3128.1259242400
14499309
InChI=1/C7H4FNO2S/c8-12(10,11)7-4-2-1-3-6(7)5-9/h1-4H
C7H4FNO2S185.1756232100
12345

Advertisement