2D Structure | |
CID | 15923779 |
Target | / |
IUPAC Name | (1aR,4aR,7aR,7bR)-1,1,7-trimethyl-4-methylidene-2,3,4a,5,7a,7b-hexahydro-1aH-cyclopropa[e]azulene |
InChI | InChI=1S/C15H22/c1-9-6-8-12-14(15(12,3)4)13-10(2)5-7-11(9)13/h5,11-14H,1,6-8H2,2-4H3/t11-,12+,13+,14+/m0/s1 |
InChI Key | HDUMORZKKNOYSS-REWJHTLYSA-N |
Canonical SMILES | CC1=CCC2C1C3C(C3(C)C)CCC2=C |
Isomeric SMILES | CC1=CC[C@@H]2[C@@H]1[C@H]3[C@H](C3(C)C)CCC2=C |
Molecular Formula | C15H22 |
Molecular Weight | 202.33 |
synonyms | ['53526-64-0', '(1aR,4aR,7aR,7bR)-1a,2,3,4,4a,5,7a,7b-Octahydro-1,1,7-trimethyl-4-methylene-1H-cycloprop[e]azulene', '(1aR,4aR,7aR,7bR)-1a,2,3,4,4a,5,7a,7b-Octahydro-1,1,7-trimethyl-4-methylene-1H-cycloprop(e)azulene', 'beta-Spathulene', 'Spathulene, beta-', 'TB6UA4EHU7', 'DTXSID601115098', '1H-Cycloprop[e]azulene, 1a,2,3,4,4a,5,7a,7b-octahydro-1,1,7-trimethyl-4-methylene-, (1aR,4aR,7aR,7bR)-', '1H-Cycloprop[e]azulene, 1a,2,3,4,4a,5,7a,7b-octahydro-1,1,7-trimethyl-4-methylene-, [1aR-(1aalpha,4aalpha,7abeta,7balpha)]-'] |
From Pubchem