| SpectraBase Spectrum ID |
C4jqlA04Oqc |
| Name |
1(2H)-Pentalenone, hexahydro-4-methyl-5-methylene-, (3a.alpha.,4.beta.,6a.alpha.)- |
| Alternate Name(s) |
(3a.alpha.,4.beta.,6a.alpha.)-hexahydro-4-methyl-5-methylene-1(2H)-pentalenone
(3aS,4R,6aR)-4-methyl-5-methylenehexahydro-1(2H)-pentalenone |
| CAS Registry Number |
79390-46-8 |
| Comments |
Edited after expert review for acetone contamination - Original record with SpectrumID 1147496 moved to the Legacy library |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H14O |
| InChI |
InChI=1S/C10H14O/c1-6-5-9-8(7(6)2)3-4-10(9)11/h7-9H,1,3-5H2,2H3/t7-,8-,9+/m0/s1 |
| InChIKey |
ACXFTHINQIURNV-XHNCKOQMSA-N |
| Molecular Weight |
150.221 g/mol |
| SMILES |
C1(C[C@]2(C(=O)CC[C@]2([C@]1(C)[H])[H])[H])=C |
| SPLASH |
splash10-0006-9000000000-e0c5dbbe7626e49c350a |
| Source of Spectrum |
C-107-1297-0 |
| Wiley ID |
1821453 |
