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4,4,5-Trimethoxy-2-cyclohexen-1-one
SpectraBase Compound ID 6D7ZRVHvM8H
InChI InChI=1S/C9H14O4/c1-11-8-6-7(10)4-5-9(8,12-2)13-3/h4-5,8H,6H2,1-3H3
InChIKey ZQHHMYJNVYHAFC-UHFFFAOYSA-N
Mol Weight 186.21 g/mol
Molecular Formula C9H14O4
Exact Mass 186.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KvByIWEikAm
Name 4,4,5-Trimethoxy-2-cyclohexen-1-one
Alternate Name(s) 2-Cyclohexen-1-one, 4,4,5-trimethoxy- 4,4,5-trimethoxy-1-cyclohex-2-enone 4,4,5-trimethoxycyclohex-2-en-1-one
CAS Registry Number 56180-51-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O4
InChI InChI=1S/C9H14O4/c1-11-8-6-7(10)4-5-9(8,12-2)13-3/h4-5,8H,6H2,1-3H3
InChIKey ZQHHMYJNVYHAFC-UHFFFAOYSA-N
Molecular Weight 186.207 g/mol
SMILES C1(=O)C=CC(C(C1)OC)(OC)OC
SPLASH splash10-056r-9700000000-6ed5ea94d55a31bdf0e8
Wiley ID 1488511