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

*Links on SpectraBase are not permalinks.
3,3-Pentamethylene-3-tosylpropanal
SpectraBase Compound ID 3lqcCSBg6wX
InChI InChI=1S/C15H20O3S/c1-13-5-7-14(8-6-13)19(17,18)15(11-12-16)9-3-2-4-10-15/h5-8,12H,2-4,9-11H2,1H3
InChIKey XZRFJAWNZMUGNE-UHFFFAOYSA-N
Mol Weight 280.38 g/mol
Molecular Formula C15H20O3S
Exact Mass 280.113316 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 5J3obEpP2kM
Name 3,3-Pentamethylene-3-tosylpropanal
Alternate Name(s) {1-[(4-Methylphenyl)sulfonyl]cyclohexyl}acetaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O3S
InChI InChI=1S/C15H20O3S/c1-13-5-7-14(8-6-13)19(17,18)15(11-12-16)9-3-2-4-10-15/h5-8,12H,2-4,9-11H2,1H3
InChIKey XZRFJAWNZMUGNE-UHFFFAOYSA-N
Molecular Weight 280.382 g/mol
SMILES C1(S(c2ccc(cc2)C)(=O)=O)(CC=O)CCCCC1
SPLASH splash10-0006-9000000000-2decc5f731142bf341ec
Source of Spectrum F-52-4119-9
Wiley ID 795834