| SpectraBase Spectrum ID |
7nQTv4D5JR4 |
| Name |
4H-Quinolizin-4-one, 8-(formyloxy)octahydro-6-(3-iodo-4-methoxyphenyl)-, (6.alpha.,8.alpha.,9a.alpha.)-(.+-.)- |
| Alternate Name(s) |
(2R,4S,9aR)-4-(3-iodo-4-methoxyphenyl)-6-oxooctahydro-2H-quinolizin-2-yl formate
(6.alpha.,8.alpha.,9a.alpha.)-(+,-)-octahydro-8-(formyloxy)-6-(3-iodo-4-methoxyphenyl)-4H-quinolizin-4-one |
| CAS Registry Number |
97974-67-9 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H20INO4 |
| InChI |
InChI=1S/C17H20INO4/c1-22-16-6-5-11(7-14(16)18)15-9-13(23-10-20)8-12-3-2-4-17(21)19(12)15/h5-7,10,12-13,15H,2-4,8-9H2,1H3/t12-,13-,15+/m1/s1 |
| InChIKey |
RTWVSBWPEJQYLO-NFAWXSAZSA-N |
| Molecular Weight |
429.254 g/mol |
| SMILES |
[C@]1(N2[C@@](C[C@](C1)(OC=O)[H])(CCCC2=O)[H])(c1cc(I)c(cc1)OC)[H] |
| SPLASH |
splash10-0059-0002900000-759f46cadd066ace912b |
| Source of Spectrum |
J-52-4670-28 |
| Wiley ID |
1381107 |
