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ISOPROPYL-4-NITROBENZOATE
SpectraBase Compound ID FsII9uqzM7j
InChI InChI=1S/C10H11NO4/c1-7(2)15-10(12)8-3-5-9(6-4-8)11(13)14/h3-7H,1-2H3
InChIKey JSZSPHFHMMXJEU-UHFFFAOYSA-N
Mol Weight 209.2 g/mol
Molecular Formula C10H11NO4
Exact Mass 209.068808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6YonvIHPDT7
Name Benzoic acid, 4-nitro-, 1-methylethyl ester
CAS Registry Number 13756-40-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H11NO4
InChI InChI=1S/C10H11NO4/c1-7(2)15-10(12)8-3-5-9(6-4-8)11(13)14/h3-7H,1-2H3
InChIKey JSZSPHFHMMXJEU-UHFFFAOYSA-N
Molecular Weight 209.201 g/mol
SMILES CC(OC(=O)c1ccc(N(=O)=O)cc1)C
SPLASH splash10-0uxr-3900000000-1b601eedeb24bbdd42c6
Source of Spectrum GT-1986-37-0
Synonyms Isopropyl 4-nitrobenzoate 4-Nitrobenzoic acid isopropyl ester 4-Nitrobenzoic acid propan-2-yl ester Benzoic acid, 4-nitro, isopropyl ester Propan-2-yl 4-nitrobenzoate i-Propyl 4-nitrobenzoate 4-Nitrobenzoic acid, isopropyl ester
Wiley ID 1207966