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Benzoic acid, 2,4,6-trimethyl-, (3-nitrophenyl)methyl ester
SpectraBase Compound ID FQOddC8LcNc
InChI InChI=1S/C17H17NO4/c1-11-7-12(2)16(13(3)8-11)17(19)22-10-14-5-4-6-15(9-14)18(20)21/h4-9H,10H2,1-3H3
InChIKey VOVKSONPBIGDJY-UHFFFAOYSA-N
Mol Weight 299.33 g/mol
Molecular Formula C17H17NO4
Exact Mass 299.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E0ee0AYF9Gr
Name Benzoic acid, 2,4,6-trimethyl-, (3-nitrophenyl)methyl ester
CAS Registry Number 86096-88-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17NO4
InChI InChI=1S/C17H17NO4/c1-11-7-12(2)16(13(3)8-11)17(19)22-10-14-5-4-6-15(9-14)18(20)21/h4-9H,10H2,1-3H3
InChIKey VOVKSONPBIGDJY-UHFFFAOYSA-N
Molecular Weight 299.326 g/mol
SMILES c1(N(=O)=O)cc(COC(c2c(cc(cc2C)C)C)=O)ccc1
SPLASH splash10-03di-0900000000-f0719a54a035cc0340b3
Source of Spectrum B-36-91-0
Synonyms 3-Nitrobenzyl 2,4,6-trimethylbenzoate M-nitrobenzyl 2,4,6-trimethylbenzoate M-nitrobenzyl mesitoate
Wiley ID 1302016