| SpectraBase Spectrum ID |
3INgFykwVc |
| Name |
(2S)-2-[(3-bromo-4,5,6,7-tetrahydroisobenzothiophene-1-carbonyl)amino]glutaric acid dimethyl ester |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H20BrNO5S |
| InChI |
InChI=1S/C16H20BrNO5S/c1-22-12(19)8-7-11(16(21)23-2)18-15(20)13-9-5-3-4-6-10(9)14(17)24-13/h11H,3-8H2,1-2H3,(H,18,20)/t11-/m0/s1 |
| InChIKey |
YZCQAWYEGKKFMZ-NSHDSACASA-N |
| Molecular Weight |
418.302 g/mol |
| SMILES |
N(C(c1sc(Br)c2c1CCCC2)=O)[C@](C(=O)OC)(CCC(=O)OC)[H] |
| SPLASH |
splash10-0006-0090000000-bac2a311bb3a7b86b237 |
| Source of Spectrum |
J-62-1602-8 |
| Synonyms |
(2S)-2-[[(3-bromo-4,5,6,7-tetrahydro-2-benzothiophen-1-yl)-oxomethyl]amino]pentanedioic acid dimethyl ester
dimethyl (2S)-2-[(3-bromanyl-4,5,6,7-tetrahydro-2-benzothiophen-1-yl)carbonylamino]pentanedioate
dimethyl (2S)-2-[(3-bromo-4,5,6,7-tetrahydro-2-benzothiophene-1-carbonyl)amino]pentanedioate |
| Wiley ID |
1376756 |
![(2S)-2-[(3-bromo-4,5,6,7-tetrahydroisobenzothiophene-1-carbonyl)amino]glutaric acid dimethyl ester](/api/spectrum/3INgFykwVc/structure.png?h=300&w=458 "(2S)-2-[(3-bromo-4,5,6,7-tetrahydroisobenzothiophene-1-carbonyl)amino]glutaric acid dimethyl ester")
