| SpectraBase Spectrum ID |
CQ1J2fCXN1g |
| Name |
1-[ (1R,3aR*,7aS*)-Hexahydro-3a-methyl-7-methylene-1-indanyl]-2-methylpropenyl Isocyanate |
| CAS Registry Number |
127488-48-6 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H23NO |
| InChI |
InChI=1S/C16H23NO/c1-11(2)15(17-10-18)13-7-9-16(4)8-5-6-12(3)14(13)16/h13-14H,3,5-9H2,1-2,4H3/t13-,14-,16-/m1/s1 |
| InChIKey |
XJOWENPZCCTPSW-IIAWOOMASA-N |
| Molecular Weight |
245.366 g/mol |
| SMILES |
[C@@]1(C(N=C=O)=C(C)C)([C@@]2([C@@](CCCC2=C)(C)CC1)[H])[H] |
| SPLASH |
splash10-00e9-0930000000-8b1f69c44ae2699739c3 |
| Source of Spectrum |
J-57-2028-57 |
| Synonyms |
(1R,3aR,7aS)-1-(1-isocyanato-2-methyl-1-propenyl)-3a-methyl-7-methyleneoctahydro-1H-indene |
| Wiley ID |
1248225 |
![1-[ (1R,3aR*,7aS*)-Hexahydro-3a-methyl-7-methylene-1-indanyl]-2-methylpropenyl Isocyanate](/api/spectrum/CQ1J2fCXN1g/structure.png?h=300&w=458 "1-[ (1R,3aR*,7aS*)-Hexahydro-3a-methyl-7-methylene-1-indanyl]-2-methylpropenyl Isocyanate")
