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Butanoic acid, 2-methyl-2-(phenylmethoxy)-, methyl ester, (.+-.)-
SpectraBase Compound ID CWnZZ3m3pzW
InChI InChI=1S/C13H18O3/c1-4-13(2,12(14)15-3)16-10-11-8-6-5-7-9-11/h5-9H,4,10H2,1-3H3
InChIKey KRTOFGWFCNEEHA-UHFFFAOYSA-N
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ix9jptXxPJc
Name Butanoic acid, 2-methyl-2-(phenylmethoxy)-, methyl ester, (.+-.)-
Alternate Name(s) Methyl 2-(benzyloxy)-2-methylbutanoate
CAS Registry Number 128549-11-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-4-13(2,12(14)15-3)16-10-11-8-6-5-7-9-11/h5-9H,4,10H2,1-3H3
InChIKey KRTOFGWFCNEEHA-UHFFFAOYSA-N
Molecular Weight 222.284 g/mol
SMILES C(C(OCc1ccccc1)(CC)C)(=O)OC
SPLASH splash10-0006-9100000000-43198730d573cce5ab07
Source of Spectrum J-55-4645-4
Wiley ID 1222640