| SpectraBase Spectrum ID |
q14oFM5WzH |
| Name |
(Z)-N-Acetyl-7-bromo-2-ethoxycarbonyl-5-methoxydehydrotryptophan Methyl ester |
| Alternate Name(s) |
3-[(Z)-2-acetamido-3-methoxy-3-oxoprop-1-enyl]-7-bromo-1H-indole-2-carboxylic acid ethyl ester
ethyl 3-[(Z)-2-acetamido-3-methoxy-3-oxoprop-1-enyl]-7-bromo-1H-indole-2-carboxylate
ethyl 3-[(Z)-2-acetamido-3-methoxy-3-oxo-prop-1-enyl]-7-bromo-1H-indole-2-carboxylate
ethyl 3-[(Z)-2-acetamido-3-methoxy-3-oxidanylidene-prop-1-enyl]-7-bromanyl-1H-indole-2-carboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H17BrN2O5 |
| InChI |
InChI=1S/C17H17BrN2O5/c1-4-25-17(23)15-11(8-13(16(22)24-3)19-9(2)21)10-6-5-7-12(18)14(10)20-15/h5-8,20H,4H2,1-3H3,(H,19,21)/b13-8- |
| InChIKey |
TYSPPKILBXWQPQ-JYRVWZFOSA-N |
| Molecular Weight |
409.236 g/mol |
| SMILES |
[nH]1c2c(c(\C=C/(C(=O)OC)NC(=O)C)c1C(=O)OCC)cccc2Br |
| SPLASH |
splash10-0900-0004900000-56a04225fd243036fb7c |
| Source of Spectrum |
E1-42-836-9 |
| Wiley ID |
1552503 |
