| SpectraBase Spectrum ID |
CORRDazWfNQ |
| Name |
2,2,6-Trimethyl-1-[(1E,3E,5E,7E)-2',6'-dimethyl-1'-nitro-1',3',5',7'-octatetraen-8'-yl]-7-oxabicyclo[4.1.0]heptane |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
317.199093730 u |
| Formula |
C19H27NO3 |
| InChI |
InChI=1S/C19H27NO3/c1-15(8-6-9-16(2)14-20(21)22)10-13-19-17(3,4)11-7-12-18(19,5)23-19/h6,8-10,13-14H,7,11-12H2,1-5H3/b9-6+,13-10+,15-8+,16-14+ |
| InChIKey |
ALVVZSFTKLPFBT-WEDZBJJJSA-N |
| Molecular Weight |
317.429 g/mol |
| SMILES |
C12(OC2(CCCC1(C)C)C)\C=C\C(=C\C=C\C(=C\N(=O)=O)C)C |
![2,2,6-Trimethyl-1-[(1E,3E,5E,7E)-2',6'-dimethyl-1'-nitro-1',3',5',7'-octatetraen-8'-yl]-7-oxabicyclo[4.1.0]heptane](/api/spectrum/CORRDazWfNQ/structure.png?h=300&w=458 "2,2,6-Trimethyl-1-[(1E,3E,5E,7E)-2',6'-dimethyl-1'-nitro-1',3',5',7'-octatetraen-8'-yl]-7-oxabicyclo[4.1.0]heptane")
