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

*Links on SpectraBase are not permalinks.
(4S,5R,10S)-(+)-Microcionin-1
SpectraBase Compound ID 7Q57eCQ7jT1
InChI InChI=1S/C15H22O/c1-11-5-4-8-15(3)13-12(7-10-16-13)6-9-14(11,15)2/h7,10-11H,4-6,8-9H2,1-3H3/t11-,14+,15+/m0/s1
InChIKey RZAVBLXEFARMMG-NILFDRSVSA-N
Mol Weight 218.34 g/mol
Molecular Formula C15H22O
Exact Mass 218.167065 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 E8hbeEf4QgT
Name (4S,5R,10S)-(+)-Microcionin-1
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 218.167065327 u
Formula C15H22O
GC Column Optima delta (20 m x 0.25 mm)
InChI InChI=1S/C15H22O/c1-11-5-4-8-15(3)13-12(7-10-16-13)6-9-14(11,15)2/h7,10-11H,4-6,8-9H2,1-3H3/t11-,14+,15+/m0/s1
InChIKey RZAVBLXEFARMMG-NILFDRSVSA-N
Instrument Name Finnigan trace GC-MS
Ionization Type EI
Literature Reference DOI 10.1002/chem.201404766
Molecular Weight 218.340 g/mol
Optical Rotation [a]D20 = +77 (c = 0.018, CHCl3)
Quality 467
SMILES C1CC[C@@]([C@]2(CCC3=C([C@@]12C)OC=C3)C)(C)[H]
SPLASH splash10-0udi-3970000000-3790efcf0d337521086b
Source of Spectrum QE-21-400-4 (DOI: 10.1002/chem.201404766)
Wiley ID 1906272