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

*Links on SpectraBase are not permalinks.
(+-)-(3aRS,5RS,6aSR,7RS,9aSR)-7-Methyl-5-phenyloctahydrodicyclopenta[d,e][1,3]dioxine
SpectraBase Compound ID KmXtsbiwhhK
InChI InChI=1S/C17H22O2/c1-12-9-11-17-10-5-8-14(17)18-16(19-15(12)17)13-6-3-2-4-7-13/h2-4,6-7,12,14-16H,5,8-11H2,1H3/t12-,14-,15+,16-,17+/m1/s1
InChIKey UTRGKKJTMFAKNJ-CMZRPVNOSA-N
Mol Weight 258.36 g/mol
Molecular Formula C17H22O2
Exact Mass 258.16198 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 AQQcxfdUGuZ
Name (+-)-(3aRS,5RS,6aSR,7RS,9aSR)-7-Methyl-5-phenyloctahydrodicyclopenta[d,e][1,3]dioxine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O2
InChI InChI=1S/C17H22O2/c1-12-9-11-17-10-5-8-14(17)18-16(19-15(12)17)13-6-3-2-4-7-13/h2-4,6-7,12,14-16H,5,8-11H2,1H3/t12-,14-,15+,16-,17+/m1/s1
InChIKey UTRGKKJTMFAKNJ-CMZRPVNOSA-N
Molecular Weight 258.361 g/mol
SMILES [C@]123[C@@](O[C@@](O[C@@]3(CCC1)[H])(c1ccccc1)[H])([C@](C)(CC2)[H])[H]
SPLASH splash10-052u-5900000000-63e282e5d184f1521751
Source of Spectrum Y2-26-528-3
Synonyms (3aRS,5RS,6aSR,7RS,9aSR)-7-Methyl-5-phenyl-(octahydro)dicyclopenta[d,e]-(1,3)-dioxine
Wiley ID 1547231