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2H-Pyran-4-acetic acid, 6-ethyl-5-(methoxycarbonyl)-2-oxo-
SpectraBase Compound ID Absmxv0O2YQ
InChI InChI=1S/C11H12O6/c1-3-7-10(11(15)16-2)6(4-8(12)13)5-9(14)17-7/h5H,3-4H2,1-2H3,(H,12,13)
InChIKey QSCSEJJTLGFZNM-UHFFFAOYSA-N
Mol Weight 240.21 g/mol
Molecular Formula C11H12O6
Exact Mass 240.063388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8jrfXTlTGwq
Name 2H-Pyran-4-acetic acid, 6-ethyl-5-(methoxycarbonyl)-2-oxo-
Alternate Name(s) 6-Ethyl-5-(methoxycarbonyl)-2-oxo-2H-pyran-4-acetic acid [6-ethyl-5-(methoxycarbonyl)-2-oxo-2H-pyran-4-yl]acetic acid 2-(2-Ethyl-3-methoxycarbonyl-6-oxo-4-pyranyl)acetic acid 2-(2-Ethyl-3-methoxycarbonyl-6-oxopyran-4-yl)acetic acid 2-(2-Ethyl-3-methoxycarbonyl-6-oxo-pyran-4-yl)acetic acid 2-(2-Ethyl-3-methoxycarbonyl-6-oxidanylidene-pyran-4-yl)ethanoic acid
CAS Registry Number 107941-36-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O6
InChI InChI=1S/C11H12O6/c1-3-7-10(11(15)16-2)6(4-8(12)13)5-9(14)17-7/h5H,3-4H2,1-2H3,(H,12,13)
InChIKey QSCSEJJTLGFZNM-UHFFFAOYSA-N
Molecular Weight 240.211 g/mol
SMILES OC(CC=1C(=C(OC(=O)C1)CC)C(=O)OC)=O
SPLASH splash10-066u-5900000000-79e0dfd4b25b2ddaa0ae
Source of Spectrum J-52-1900-42
Wiley ID 1242522