| SpectraBase Spectrum ID |
CBQRHfNIv6K |
| Name |
(2E)-5-[(3RS,4S)-3,4-Propane-2,2-diyldioxy-2,6,6-trimethylcyclohex-2-enyl]-3-methyl-2-penten-4-ynal |
| Alternate Name(s) |
(2E)-5-[(7aS)-2,2,4,6,6-pentamethyl-5,6,7,7a-tetrahydro-1,3-benzodioxol-5-yl]-3-methyl-2-penten-4-ynal |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H24O3 |
| InChI |
InChI=1S/C18H24O3/c1-12(9-10-19)7-8-14-13(2)16-15(11-17(14,3)4)20-18(5,6)21-16/h9-10,14-15H,11H2,1-6H3/b12-9+/t14?,15-/m0/s1 |
| InChIKey |
QEYSHPMUNDAZEA-RDGDSSBOSA-N |
| Molecular Weight |
288.387 g/mol |
| SMILES |
C12=C(C(C#C\C(=C\C=O)C)C(C[C@@]2(OC(O1)(C)C)[H])(C)C)C |
| SPLASH |
splash10-0006-8930000000-c196a88a4060ed7f7355 |
| Source of Spectrum |
SB-51-1211-5 |
| Wiley ID |
1291978 |
![(2E)-5-[(3RS,4S)-3,4-Propane-2,2-diyldioxy-2,6,6-trimethylcyclohex-2-enyl]-3-methyl-2-penten-4-ynal](/api/spectrum/CBQRHfNIv6K/structure.png?h=300&w=458 "(2E)-5-[(3RS,4S)-3,4-Propane-2,2-diyldioxy-2,6,6-trimethylcyclohex-2-enyl]-3-methyl-2-penten-4-ynal")
