For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
[(1R,7aR)-7a-methyl-5-oxo-2,3,6,7-tetrahydro-1H-inden-1-yl] phenyl carbonate
SpectraBase Compound ID 6wMyTeMdkGt
InChI InChI=1S/C17H18O4/c1-17-10-9-13(18)11-12(17)7-8-15(17)21-16(19)20-14-5-3-2-4-6-14/h2-6,11,15H,7-10H2,1H3/t15-,17-/m1/s1
InChIKey UICWEHGLMNBRQZ-NVXWUHKLSA-N
Mol Weight 286.33 g/mol
Molecular Formula C17H18O4
Exact Mass 286.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID EGOj5Wm2Zgx
Name [(1R,7aR)-7a-methyl-5-oxo-2,3,6,7-tetrahydro-1H-inden-1-yl] phenyl carbonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 286.120509056 u
Formula C17H18O4
InChI InChI=1S/C17H18O4/c1-17-10-9-13(18)11-12(17)7-8-15(17)21-16(19)20-14-5-3-2-4-6-14/h2-6,11,15H,7-10H2,1H3/t15-,17-/m1/s1
InChIKey UICWEHGLMNBRQZ-NVXWUHKLSA-N
Instrument Name Bruker MicroTOF QII or Waters Xevo G2-XS or Waters GCT or Waters LCT
Ionization Type EI Positive ion
Literature Reference DOI 10.1002/chem.202202429
Quality 67
SMILES [C@@]12(CCC(C=C2CC[C@]1(OC(=O)OC1=CC=CC=C1)[H])=O)C
SPLASH splash10-0007-9700000000-105a762bba431814bb67
Source of Spectrum QE-28-SM23-S2 (DOI: 10.1002/chem.202202429)
Thin-Layer Chromatography 0.19 (25% EtOAc/petroleum ether)
Wiley ID 1900784