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(3-chlorophenyl)methyl 4-nitrobenzoate
SpectraBase Compound ID EPtBpXOdx31
InChI InChI=1S/C14H10ClNO4/c15-12-3-1-2-10(8-12)9-20-14(17)11-4-6-13(7-5-11)16(18)19/h1-8H,9H2
InChIKey XHKVHONUELAUPU-UHFFFAOYSA-N
Mol Weight 291.69 g/mol
Molecular Formula C14H10ClNO4
Exact Mass 291.029836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BRZIC9CzHzP
Name (3-chlorophenyl)methyl 4-nitrobenzoate
Alternate Name(s) 4-Nitrobenzoic acid (3-chlorobenzyl) ester 4-Nitrobenzoic acid (3-chlorophenyl)methyl ester
CAS Registry Number 53218-05-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H10ClNO4
InChI InChI=1S/C14H10ClNO4/c15-12-3-1-2-10(8-12)9-20-14(17)11-4-6-13(7-5-11)16(18)19/h1-8H,9H2
InChIKey XHKVHONUELAUPU-UHFFFAOYSA-N
Molecular Weight 291.690 g/mol
SMILES c1(N(=O)=O)ccc(C(OCc2cc(Cl)ccc2)=O)cc1
SPLASH splash10-014i-0900000000-04dd7af03ef584af61fa
Source of Spectrum W5-26199-0-0
Wiley ID 1294399