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4-Nitrobenzoic acid octadecyl ester
SpectraBase Compound ID L3tcYltyAQM
InChI InChI=1S/C25H41NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-30-25(27)23-18-20-24(21-19-23)26(28)29/h18-21H,2-17,22H2,1H3
InChIKey TYELDTDLXFVFGB-UHFFFAOYSA-N
Mol Weight 419.6 g/mol
Molecular Formula C25H41NO4
Exact Mass 419.303559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7I5MaVn1a8X
Name 4-Nitrobenzoic acid octadecyl ester
Alternate Name(s) 4-Nitrobenzoic acid stearyl ester Octadecyl 4-nitrobenzoate
CAS Registry Number 56426-96-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H41NO4
InChI InChI=1S/C25H41NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-30-25(27)23-18-20-24(21-19-23)26(28)29/h18-21H,2-17,22H2,1H3
InChIKey TYELDTDLXFVFGB-UHFFFAOYSA-N
Molecular Weight 419.606 g/mol
SMILES c1(N(=O)=O)ccc(C(=O)OCCCCCCCCCCCCCCCCCC)cc1
SPLASH splash10-066u-9500000000-e0f7bffd46961445cd37
Source of Spectrum B-28-1013-1
Wiley ID 1377646