| SpectraBase Spectrum ID |
DCLvm9nEhdl |
| Name |
(11E)-(+-)-11-Ethylidene-7,8,9,10-tetrahydro-2-methoxy-7-methylene-5,9-methanocycloocta[d]pyrimidine-5(6H)-carboxylic acid |
| Alternate Name(s) |
(13E)-13-ethylidene-5-methoxy-11-methylene-4,6-diazatricyclo[7.3.1.0(2,7)]trideca-2,4,6-triene-1-carboxylic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H18N2O3 |
| InChI |
InChI=1S/C16H18N2O3/c1-4-11-10-5-9(2)7-16(11,14(19)20)12-8-17-15(21-3)18-13(12)6-10/h4,8,10H,2,5-7H2,1,3H3,(H,19,20)/b11-4+/t10-,16+/m1/s1 |
| InChIKey |
RQDICUUEVMWHHL-USVZXYGOSA-N |
| Molecular Weight |
286.331 g/mol |
| SMILES |
OC([C@@]12\C([C@](CC(C2)=C)(Cc2c1cnc(OC)n2)[H])=C\C)=O |
| SPLASH |
splash10-001i-9010000000-727fba43298ce5871048 |
| Source of Spectrum |
KC-0-1295-20 |
| Wiley ID |
785926 |
![(11E)-(+-)-11-Ethylidene-7,8,9,10-tetrahydro-2-methoxy-7-methylene-5,9-methanocycloocta[d]pyrimidine-5(6H)-carboxylic acid](/api/spectrum/DCLvm9nEhdl/structure.png?h=300&w=458 "(11E)-(+-)-11-Ethylidene-7,8,9,10-tetrahydro-2-methoxy-7-methylene-5,9-methanocycloocta[d]pyrimidine-5(6H)-carboxylic acid")
