| SpectraBase Spectrum ID |
2uFMxPDupds |
| Name |
2-(Benzyloxy)-2,3-dimethylpentan-1,5-dioic diacid retronecine ester |
| Alternate Name(s) |
(4aR,12bR)-9-(benzyloxy)-8,9-dimethyl-2,3,4,4a,8,9,12,12b-octahydro-6H-5,11-dioxa-2a-azacycloundeca[cd]pentalene-6,10(7H)-dione |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H27NO5 |
| InChI |
InChI=1S/C22H27NO5/c1-15-12-19(24)28-18-9-11-23-10-8-17(20(18)23)14-26-21(25)22(15,2)27-13-16-6-4-3-5-7-16/h3-8,15,18,20H,9-14H2,1-2H3/t15?,18-,20-,22?/m1/s1 |
| InChIKey |
UKOPPRQIGRESIX-BOHAGERGSA-N |
| Molecular Weight |
385.460 g/mol |
| SMILES |
C1(C(OCC=2[C@]3(N(CC2)CC[C@]3(OC(CC1C)=O)[H])[H])=O)(OCc1ccccc1)C |
| SPLASH |
splash10-014r-1950000000-45dfef7dc1912029878d |
| Source of Spectrum |
J-61-1476-9 |
| Wiley ID |
1362267 |
