| SpectraBase Spectrum ID |
8t1QhWVpOHz |
| Name |
(3S*,3aR*,7aS*)-3-[3-Fluoro-4-(methoxymethoxy)benzyl]-7-methylene-1,2,3,3a,7,7a-hexahydro-4H-inden-4-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H21FO3 |
| InChI |
InChI=1S/C19H21FO3/c1-12-3-7-17(21)19-14(5-6-15(12)19)9-13-4-8-18(16(20)10-13)23-11-22-2/h3-4,7-8,10,14-15,19H,1,5-6,9,11H2,2H3/t14-,15+,19+/m0/s1 |
| InChIKey |
FPQFXPFRXORFHM-QMTMVMCOSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/ml300283f |
| Molecular Weight |
316.372 g/mol |
| Reported Formula |
C19H21FO3 |
| SMILES |
[C@@]1(CC[C@]2([C@@]1(C(C=CC2=C)=O)[H])[H])(Cc1cc(c(cc1)OCOC)F)[H] |
| SPLASH |
splash10-0a4j-1901000000-edade69c997002926b26 |
| Source of Spectrum |
MCS-3-SM17-10c |
| Wiley ID |
1864107 |
![(3S*,3aR*,7aS*)-3-[3-Fluoro-4-(methoxymethoxy)benzyl]-7-methylene-1,2,3,3a,7,7a-hexahydro-4H-inden-4-one](/api/spectrum/8t1QhWVpOHz/structure.png?h=300&w=458 "(3S*,3aR*,7aS*)-3-[3-Fluoro-4-(methoxymethoxy)benzyl]-7-methylene-1,2,3,3a,7,7a-hexahydro-4H-inden-4-one")
