| SpectraBase Compound ID | HSS3fCPHnd9 |
|---|---|
| InChI | InChI=1S/C29H34N2O4/c1-20-15-27(32)31(28(20)33)26-14-8-6-12-24(26)29(34)35-19-22-16-23-11-5-7-13-25(23)30(18-22)17-21-9-3-2-4-10-21/h2-4,6,8-10,12,14,20,22-23,25H,5,7,11,13,15-19H2,1H3/t20?,22-,23+,25+/m1/s1 |
| InChIKey | OUSNHPHLRIQFDI-NHZFOIJFSA-N |
| Mol Weight | 474.6 g/mol |
| Molecular Formula | C29H34N2O4 |
| Exact Mass | 474.251858 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8I9jsACCyvP |
|---|---|
| Name | 2-(3-Methyl-2,5-dioxo-pyrrolidin-1-yl)-benzoic acid (3R,4aS,8aS)-1-benzyl-decahydro-quinolin-3-ylmethyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H34N2O4 |
| InChI | InChI=1S/C29H34N2O4/c1-20-15-27(32)31(28(20)33)26-14-8-6-12-24(26)29(34)35-19-22-16-23-11-5-7-13-25(23)30(18-22)17-21-9-3-2-4-10-21/h2-4,6,8-10,12,14,20,22-23,25H,5,7,11,13,15-19H2,1H3/t20?,22-,23+,25+/m1/s1 |
| InChIKey | OUSNHPHLRIQFDI-NHZFOIJFSA-N |
| Molecular Weight | 474.601 g/mol |
| SMILES | C1(N(C(C(C1)C)=O)c1c(C(OC[C@]2(CN(Cc3ccccc3)[C@@]3([C@](C2)(CCCC3)[H])[H])[H])=O)cccc1)=O |
| SPLASH | splash10-059x-8110900000-c508bb5d75ab13195547 |
| Source of Spectrum | U1-2009-1959-5b |
| Wiley ID | 1662775 |