| SpectraBase Spectrum ID |
D9oyndzCGig |
| Name |
(E/Z)-dimethyl 2-[1-benzyl-3,4-dibromo-but-2-enyl]propanedioate |
| Appearance |
Colorless thick oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
431.957185056 u |
| Formula |
C16H18Br2O4 |
| InChI |
InChI=1S/C16H18Br2O4/c1-21-15(19)14(16(20)22-2)12(9-13(18)10-17)8-11-6-4-3-5-7-11/h3-7,9,12,14H,8,10H2,1-2H3 |
| InChIKey |
UUZGCQHZIJYFNK-UHFFFAOYSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201803541 |
| Molecular Weight |
434.124 g/mol |
| Quality |
390 |
| Reported Formula |
C16H18(79)Br2O4 |
| SMILES |
COC(C(C(=O)OC)C(C=C(CBr)Br)CC1=CC=CC=C1)=O |
| SPLASH |
splash10-0006-9543000000-883427f4b6edb7caf71d |
| Sample Comments |
Mixtute of E/Z |
| Source of Spectrum |
ACI-57-SM22-7c (DOI: 10.1002/anie.201803541) |
| Wiley ID |
1893199 |
![(E/Z)-dimethyl 2-[1-benzyl-3,4-dibromo-but-2-enyl]propanedioate](/api/spectrum/D9oyndzCGig/structure.png?h=300&w=458 "(E/Z)-dimethyl 2-[1-benzyl-3,4-dibromo-but-2-enyl]propanedioate")
