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

*Links on SpectraBase are not permalinks.
2-Cyclohexen-1-one, 3-(3-hydroxy-1-butenyl)-2,4,4,5-tetramethyl-
SpectraBase Compound ID 4GR1ZOaDaGV
InChI InChI=1S/C14H22O2/c1-9-8-13(16)11(3)12(14(9,4)5)7-6-10(2)15/h6-7,9-10,15H,8H2,1-5H3/b7-6+
InChIKey PHDIWIGXBYRDID-VOTSOKGWSA-N
Mol Weight 222.33 g/mol
Molecular Formula C14H22O2
Exact Mass 222.16198 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 InbnTq9ZCaJ
Name 2-Cyclohexen-1-one, 3-(3-hydroxy-1-butenyl)-2,4,4,5-tetramethyl-
CAS Registry Number 68931-36-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O2
InChI InChI=1S/C14H22O2/c1-9-8-13(16)11(3)12(14(9,4)5)7-6-10(2)15/h6-7,9-10,15H,8H2,1-5H3/b7-6+
InChIKey PHDIWIGXBYRDID-VOTSOKGWSA-N
Molecular Weight 222.328 g/mol
SMILES OC(\C=C\C1=C(C(=O)CC(C1(C)C)C)C)C
SPLASH splash10-056u-5910000000-1ebcd94d8275448cd911
Source of Spectrum H-61-2334-0
Synonyms 3-[(1E)-3-hydroxy-1-butenyl]-2,4,4,5-tetramethyl-2-cyclohexen-1-one 4-(2,5,6,6-Tetramethyl-3-oxo-cyclohex-1-en-1-yl)but-3-en-2-ol 4-OXO-.beta.-IROL
Wiley ID 1222821