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

*Links on SpectraBase are not permalinks.
4,6-Bis(hydroxymethyl)-3-methyl-2-butylhexahydropentalen-1(2H)-one
SpectraBase Compound ID 3MTrmR89UEa
InChI InChI=1S/C15H26O3/c1-3-4-5-12-9(2)13-10(7-16)6-11(8-17)14(13)15(12)18/h9-14,16-17H,3-8H2,1-2H3
InChIKey OATQKUGWGMOEIW-UHFFFAOYSA-N
Mol Weight 254.37 g/mol
Molecular Formula C15H26O3
Exact Mass 254.188195 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 LgRdkRa9yHK
Name 4,6-Bis(hydroxymethyl)-3-methyl-2-butylhexahydropentalen-1(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H26O3
InChI InChI=1S/C15H26O3/c1-3-4-5-12-9(2)13-10(7-16)6-11(8-17)14(13)15(12)18/h9-14,16-17H,3-8H2,1-2H3
InChIKey OATQKUGWGMOEIW-UHFFFAOYSA-N
Molecular Weight 254.370 g/mol
SMILES OCC1C2C(C(C(C2C(CO)C1)C)CCCC)=O
SPLASH splash10-001i-3900000000-c8447109bb5329841f0e
Source of Spectrum K1-0-2219-10
Synonyms 2-Butyl-4,6-bis(hydroxymethyl)-3-methylhexahydro-1(2H)-pentalenone
Wiley ID 1588885