| SpectraBase Spectrum ID |
Jzig7O3nZp4 |
| Name |
(1SR,4E,8E,12SR,15SR)-15-Acetoxy-1,5,9-trimethyl-14-oxobicyclo[10.2.2]hexadeca-4,8-diene-5-one |
| Alternate Name(s) |
(1S,12S)-4,8,12-trimethyl-15-oxobicyclo[10.2.2]hexadeca-4,8-dien-13-yl acetate
(1SR,4E,8E,12SR,15SR)-15-Acetoxy-1,5,9-trimethyl-bicyclo[10.2.2]hexadeca-4,8-diene-13-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H32O3 |
| InChI |
InChI=1S/C21H32O3/c1-15-7-5-8-16(2)10-11-18-13-20(24-17(3)22)21(4,12-6-9-15)14-19(18)23/h8-9,18,20H,5-7,10-14H2,1-4H3/b15-9+,16-8+/t18-,20-,21-/m0/s1 |
| InChIKey |
NCTPCONYIYTWHO-AUXIPXMPSA-N |
| Molecular Weight |
332.484 g/mol |
| SMILES |
[C@@]12([C@](C[C@@](C(C2)=O)(CC\C(C)=C\CC\C(=C\CC1)C)[H])(OC(=O)C)[H])C |
| SPLASH |
splash10-001i-9000000000-7f9023d1e4d71ddc8f65 |
| Source of Spectrum |
KC-1993-224-28 |
| Wiley ID |
778674 |
![(1SR,4E,8E,12SR,15SR)-15-Acetoxy-1,5,9-trimethyl-14-oxobicyclo[10.2.2]hexadeca-4,8-diene-5-one](/api/spectrum/Jzig7O3nZp4/structure.png?h=300&w=458 "(1SR,4E,8E,12SR,15SR)-15-Acetoxy-1,5,9-trimethyl-14-oxobicyclo[10.2.2]hexadeca-4,8-diene-5-one")
