| SpectraBase Spectrum ID |
3CfEYjNu6oj |
| Name |
(E)-3-[(2S,3R)-2-[(1R)-3-bromo-1-hydroxy-but-3-enyl]-4-keto-1-(4-methoxyphenyl)azetidin-3-yl]oxyacrylic acid methyl ester |
| Alternate Name(s) |
(E)-3-[[(2S,3R)-2-[(1R)-3-bromo-1-hydroxybut-3-enyl]-1-(4-methoxyphenyl)-4-oxo-3-azetidinyl]oxy]-2-propenoic acid methyl ester
methyl (E)-3-[(2S,3R)-2-[(1R)-3-bromanyl-1-oxidanyl-but-3-enyl]-1-(4-methoxyphenyl)-4-oxidanylidene-azetidin-3-yl]oxyprop-2-enoate
methyl (E)-3-[(2S,3R)-2-[(1R)-3-bromo-1-hydroxy-but-3-enyl]-1-(4-methoxyphenyl)-4-oxo-azetidin-3-yl]oxyprop-2-enoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H20BrNO6 |
| InChI |
InChI=1S/C18H20BrNO6/c1-11(19)10-14(21)16-17(26-9-8-15(22)25-3)18(23)20(16)12-4-6-13(24-2)7-5-12/h4-9,14,16-17,21H,1,10H2,2-3H3/b9-8+/t14-,16+,17-/m1/s1 |
| InChIKey |
KCYDUCLULIBWBJ-ASDNSMBMSA-N |
| Molecular Weight |
426.263 g/mol |
| SMILES |
O[C@@]([C@@]1(N(C(=O)[C@@]1(O\C=C\C(=O)OC)[H])c1ccc(cc1)OC)[H])(CC(=C)Br)[H] |
| SPLASH |
splash10-0002-0900300000-9ca3cc5150342059d06a |
| Source of Spectrum |
F4-0-2337-2 |
| Wiley ID |
1618537 |
![(E)-3-[(2S,3R)-2-[(1R)-3-bromo-1-hydroxy-but-3-enyl]-4-keto-1-(4-methoxyphenyl)azetidin-3-yl]oxyacrylic acid methyl ester](/api/spectrum/3CfEYjNu6oj/structure.png?h=300&w=458 "(E)-3-[(2S,3R)-2-[(1R)-3-bromo-1-hydroxy-but-3-enyl]-4-keto-1-(4-methoxyphenyl)azetidin-3-yl]oxyacrylic acid methyl ester")
