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3-Hydroxy-3-methyl-2-oxobutyl 2-naphthoate
SpectraBase Compound ID 64WUDDtYLrl
InChI InChI=1S/C16H16O4/c1-16(2,19)14(17)10-20-15(18)13-8-7-11-5-3-4-6-12(11)9-13/h3-9,19H,10H2,1-2H3
InChIKey JBEHDYQLCVXCMW-UHFFFAOYSA-N
Mol Weight 272.3 g/mol
Molecular Formula C16H16O4
Exact Mass 272.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 81UW4YA1OFC
Name 3-Hydroxy-3-methyl-2-oxobutyl 2-naphthoate
Appearance White crystals
Carrier Gas helium
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 272.104858991 u
Formula C16H16O4
GC Oven Program Oven temp 250oC
InChI InChI=1S/C16H16O4/c1-16(2,19)14(17)10-20-15(18)13-8-7-11-5-3-4-6-12(11)9-13/h3-9,19H,10H2,1-2H3
InChIKey JBEHDYQLCVXCMW-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP5050A
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201901226
Molecular Weight 272.300 g/mol
Quality 95
SMILES OC(C)(C(COC(=O)C=1C=CC2=C(C1)C=CC=C2)=O)C
SPLASH splash10-0a4i-0900000000-eb99cd19b7e51504bc06
Source of Spectrum K1-2019-SM7-3i (DOI: 10.1002/ejoc.201901226)
Wiley ID 1892276