| SpectraBase Spectrum ID |
KtTGBL0MJmP |
| Name |
(2S,3R,4R)-4-Benzyloxycarbonylmethyl-3-(4-methoxyphenyl)-5-oxopyrrolodine-1,2-dicarboxylic acid 1-tert-butyl ester 2-methyl ester |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H31NO8 |
| InChI |
InChI=1S/C27H31NO8/c1-27(2,3)36-26(32)28-23(25(31)34-5)22(18-11-13-19(33-4)14-12-18)20(24(28)30)15-21(29)35-16-17-9-7-6-8-10-17/h6-14,20,22-23H,15-16H2,1-5H3/t20-,22-,23-/m0/s1 |
| InChIKey |
RTIWBZWIWOMSGM-PMVMPFDFSA-N |
| Molecular Weight |
497.544 g/mol |
| SMILES |
C1(N([C@@]([C@]([C@@]1(CC(=O)OCc1ccccc1)[H])(c1ccc(cc1)OC)[H])(C(=O)OC)[H])C(OC(C)(C)C)=O)=O |
| SPLASH |
splash10-0002-0009600000-5a4f68e3d1a94c26db38 |
| Source of Spectrum |
KC-61-4975-9 |
| Wiley ID |
1629228 |
