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2-[(2R,6S)-6-methyl-2-oxanyl]acetic acid methyl ester
SpectraBase Compound ID JzXEEjXY6yW
InChI InChI=1S/C9H16O3/c1-7-4-3-5-8(12-7)6-9(10)11-2/h7-8H,3-6H2,1-2H3/t7-,8+/m1/s1
InChIKey MTOWUBNDZFQOBJ-SFYZADRCSA-N
Mol Weight 172.22 g/mol
Molecular Formula C9H16O3
Exact Mass 172.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7uPAZrJS5BH
Name 2-[(2R,6S)-6-methyl-2-oxanyl]acetic acid methyl ester
Alternate Name(s) 2H-Pyran-2-acetic acid, tetrahydro-6-methyl-, methyl ester, trans- 2-[(2R,6S)-6-methyltetrahydropyran-2-yl]acetic acid methyl ester Methyl 2-[(2R,6S)-6-methyloxan-2-yl]acetate Methyl 2-[(2R,6S)-6-methyloxan-2-yl]ethanoate Methyl 2-[(2R,6S)-6-methyltetrahydropyran-2-yl]acetate
CAS Registry Number 69493-15-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O3
InChI InChI=1S/C9H16O3/c1-7-4-3-5-8(12-7)6-9(10)11-2/h7-8H,3-6H2,1-2H3/t7-,8+/m1/s1
InChIKey MTOWUBNDZFQOBJ-SFYZADRCSA-N
Molecular Weight 172.224 g/mol
SMILES C(C(=O)OC)[C@]1(O[C@](C)(CCC1)[H])[H]
SPLASH splash10-0f6t-9300000000-ee7abee196d41014dd4b
Source of Spectrum KC-0-968-9
Wiley ID 785589