| SpectraBase Spectrum ID |
3bPh39FEQzz |
| Name |
(E)-3-[2-[(E)-3-Tert-butoxy-3-keto-prop-1-enyl]-4,4-dimethyl-cyclohexen-1-yl]acrylic acid tert-butyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
362.245709571 u |
| Formula |
C22H34O4 |
| InChI |
InChI=1S/C22H34O4/c1-20(2,3)25-18(23)11-9-16-13-14-22(7,8)15-17(16)10-12-19(24)26-21(4,5)6/h9-12H,13-15H2,1-8H3/b11-9+,12-10+ |
| InChIKey |
QMLDAXSRHBNDLZ-WGDLNXRISA-N |
| Molecular Weight |
362.510 g/mol |
| SMILES |
C1(=C(\C=C\C(OC(C)(C)C)=O)CCC(C1)(C)C)\C=C\C(OC(C)(C)C)=O |
![(E)-3-[2-[(E)-3-tert-butoxy-3-keto-prop-1-enyl]-4,4-dimethyl-cyclohexen-1-yl]acrylic acid tert-butyl ester](/api/spectrum/3bPh39FEQzz/structure.png?h=300&w=458 "(E)-3-[2-[(E)-3-tert-butoxy-3-keto-prop-1-enyl]-4,4-dimethyl-cyclohexen-1-yl]acrylic acid tert-butyl ester")
