| SpectraBase Spectrum ID |
8tw5owHLBju |
| Name |
(1R,9S,12R)-5-Methoxy-11-azatricyclo[7.3.1.0(2.7)]trideca-2(7),3,5-triene-11,12-dicarboxylic acid dimethyl ester |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H21NO5 |
| InChI |
InChI=1S/C17H21NO5/c1-21-12-4-5-13-11(8-12)6-10-7-14(13)15(16(19)22-2)18(9-10)17(20)23-3/h4-5,8,10,14-15H,6-7,9H2,1-3H3/t10-,14+,15-/m1/s1 |
| InChIKey |
HXOAVUFCKACNLG-WKPIXPDZSA-N |
| Molecular Weight |
319.357 g/mol |
| SMILES |
[C@@]1(N(C[C@@]2(Cc3cc(ccc3[C@@]1(C2)[H])OC)[H])C(=O)OC)(C(=O)OC)[H] |
| SPLASH |
splash10-03di-0091000000-bce0573f5c945c2ac50b |
| Source of Spectrum |
F-68-6684-16 |
| Synonyms |
(1R,9R,12S)-5-Methoxy-11-azatricyclo[7.3.1.0(2.7)]trideca-2(7),3,5-triene-11,12-dicarboxylic acid dimethyl ester
dimethyl (1R,9S,12R)-5-methoxy-11-azatricyclo[7.3.1.0(2,7)]trideca-2,4,6-triene-11,12-dicarboxylate |
| Wiley ID |
1573313 |
![(1R,9S,12R)-5-Methoxy-11-azatricyclo[7.3.1.0(2.7)]trideca-2(7),3,5-triene-11,12-dicarboxylic acid dimethyl ester](/api/spectrum/8tw5owHLBju/structure.png?h=300&w=458 "(1R,9S,12R)-5-Methoxy-11-azatricyclo[7.3.1.0(2.7)]trideca-2(7),3,5-triene-11,12-dicarboxylic acid dimethyl ester")
