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5-[(4-tert-Butylphenoxy)methyl]-2-furoic acid
SpectraBase Compound ID 7X1U27L528S
InChI InChI=1S/C16H18O4/c1-16(2,3)11-4-6-12(7-5-11)19-10-13-8-9-14(20-13)15(17)18/h4-9H,10H2,1-3H3,(H,17,18)
InChIKey IBCVBAKAPXHALY-UHFFFAOYSA-N
Mol Weight 274.32 g/mol
Molecular Formula C16H18O4
Exact Mass 274.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KhZvE3pvtpm
Name 5-[(4-tert-Butylphenoxy)methyl]-2-furoic acid
Alternate Name(s) 5-[(4-tert-butylphenoxy)methyl]-2-furancarboxylic acid 5-[(4-tert-butylphenoxy)methyl]furan-2-carboxylic acid Furane-2-carboxylic acid, 5-[4-(1,1-dimethylethyl)phenoxymethyl]-
CAS Registry Number 74556-54-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O4
InChI InChI=1S/C16H18O4/c1-16(2,3)11-4-6-12(7-5-11)19-10-13-8-9-14(20-13)15(17)18/h4-9H,10H2,1-3H3,(H,17,18)
InChIKey IBCVBAKAPXHALY-UHFFFAOYSA-N
Molecular Weight 274.316 g/mol
SMILES OC(c1oc(COc2ccc(C(C)(C)C)cc2)cc1)=O
SPLASH splash10-004i-5900000000-5153934a2bab136156d6
Source of Spectrum AD-0-2532-0
Wiley ID 1433975