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2-Hexenoic acid, 2,5-dimethyl-5-(3-methyl-2H-pyran-6-yl)-, methyl ester

View entire compound with spectra: 1 MS (GC)

2-Hexenoic acid, 2,5-dimethyl-5-(3-methyl-2H-pyran-6-yl)-, methyl ester
SpectraBase Compound ID 7oWG4eGmcE3
InChI InChI=1S/C15H22O3/c1-11-6-7-13(18-10-11)15(3,4)9-8-12(2)14(16)17-5/h6-8H,9-10H2,1-5H3/b12-8-
InChIKey HCGQONWIXTTYKH-WQLSENKSSA-N
Mol Weight 250.34 g/mol
Molecular Formula C15H22O3
Exact Mass 250.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4YWKW5VVKgl
Name 2-Hexenoic acid, 2,5-dimethyl-5-(3-methyl-2H-pyran-6-yl)-, methyl ester
CAS Registry Number 88354-67-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O3
InChI InChI=1S/C15H22O3/c1-11-6-7-13(18-10-11)15(3,4)9-8-12(2)14(16)17-5/h6-8H,9-10H2,1-5H3/b12-8-
InChIKey HCGQONWIXTTYKH-WQLSENKSSA-N
Molecular Weight 250.338 g/mol
SMILES C=1(OCC(=CC1)C)C(C\C=C/(C(=O)OC)C)(C)C
SPLASH splash10-000f-9500000000-9a12511bf927d507fa98
Source of Spectrum H-66-1653-0
Wiley ID 1253542