| SpectraBase Spectrum ID |
7tGICLNZE02 |
| Name |
(3S)-3-[(1R,3S,6R)-3-Methyl-2-oxo-6-(prop-1-en-2-yl)-cycloheptyl]butanal |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H24O2 |
| InChI |
InChI=1S/C15H24O2/c1-10(2)13-6-5-12(4)15(17)14(9-13)11(3)7-8-16/h8,11-14H,1,5-7,9H2,2-4H3/t11-,12-,13+,14+/m0/s1 |
| InChIKey |
QTKWSSCWAJVGRN-IGQOVBAYSA-N |
| Instrument Name |
Agilent Technologies 6890-5973N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np500819f |
| Molecular Weight |
236.355 g/mol |
| Reported Formula |
C15H24O2 |
| SMILES |
[C@@]1(C([C@@](C)(CC[C@@](C(=C)C)(C1)[H])[H])=O)([C@](CC=O)(C)[H])[H] |
| SPLASH |
splash10-07wa-9700000000-388918cf0098182cdbf1 |
| Source of Spectrum |
G4-78-144-3c |
| Wiley ID |
1865824 |
![(3S)-3-[(1R,3S,6R)-3-Methyl-2-oxo-6-(prop-1-en-2-yl)-cycloheptyl]butanal](/api/spectrum/7tGICLNZE02/structure.png?h=300&w=458 "(3S)-3-[(1R,3S,6R)-3-Methyl-2-oxo-6-(prop-1-en-2-yl)-cycloheptyl]butanal")
