| SpectraBase Spectrum ID |
K94vF6JYd0v |
| Name |
dimethyl 4,7-dihydro-8-benzylbenzo[b]thiophen-4,7-mine-5,6-dicarboxylate |
| Alternate Name(s) |
dimethyl 10-benzyl-3-thia-10-azatricyclo[5.2.1.0(2,6)]deca-2(6),4,8-triene-8,9-dicarboxylate |
| CAS Registry Number |
125302-71-8 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H17NO4S |
| InChI |
InChI=1S/C19H17NO4S/c1-23-18(21)13-14(19(22)24-2)16-17-12(8-9-25-17)15(13)20(16)10-11-6-4-3-5-7-11/h3-9,15-16H,10H2,1-2H3/t15-,16-/m0/s1 |
| InChIKey |
BWAAFLSITFOIKO-HOTGVXAUSA-N |
| Molecular Weight |
355.408 g/mol |
| SMILES |
C1(=C([C@@]2(N([C@]1(c1c2scc1)[H])Cc1ccccc1)[H])C(=O)OC)C(=O)OC |
| SPLASH |
splash10-0bt9-0079000000-6117528138b1ce4cbab9 |
| Source of Spectrum |
J-55-2449-16 |
| Wiley ID |
1345208 |
![dimethyl 4,7-dihydro-8-benzylbenzo[b]thiophen-4,7-mine-5,6-dicarboxylate](/api/spectrum/K94vF6JYd0v/structure.png?h=300&w=458 "dimethyl 4,7-dihydro-8-benzylbenzo[b]thiophen-4,7-mine-5,6-dicarboxylate")
