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4'-Chloro-3'-nitro-2-(m-pentadecylphenoxy)butyranilide

View entire compound with spectra: 1 MS (GC)

4'-Chloro-3'-nitro-2-(m-pentadecylphenoxy)butyranilide
SpectraBase Compound ID 4xGEVljB9xa
InChI InChI=1S/C31H45ClN2O4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-18-25-19-17-20-27(23-25)38-30(4-2)31(35)33-26-21-22-28(32)29(24-26)34(36)37/h17,19-24,30H,3-16,18H2,1-2H3,(H,33,35)
InChIKey MBQFWSCVWKJOKE-UHFFFAOYSA-N
Mol Weight 545.2 g/mol
Molecular Formula C31H45ClN2O4
Exact Mass 544.306786 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CPdkgghMYnx
Name 4'-Chloro-3'-nitro-2-(m-pentadecylphenoxy)butyranilide
Alternate Name(s) N-(4-chloro-3-nitrophenyl)-2-(3-pentadecylphenoxy)butanamide N-(4-chloro-3-nitro-phenyl)-2-(3-pentadecylphenoxy)butanamide N-(4-chloranyl-3-nitro-phenyl)-2-(3-pentadecylphenoxy)butanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H45ClN2O4
InChI InChI=1S/C31H45ClN2O4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-18-25-19-17-20-27(23-25)38-30(4-2)31(35)33-26-21-22-28(32)29(24-26)34(36)37/h17,19-24,30H,3-16,18H2,1-2H3,(H,33,35)
InChIKey MBQFWSCVWKJOKE-UHFFFAOYSA-N
Molecular Weight 545.164 g/mol
SMILES N(c1cc(c(cc1)Cl)[N+](=O)[O-])C(C(CC)Oc1cc(ccc1)CCCCCCCCCCCCCCC)=O
SPLASH splash10-0a4j-7903000000-d29c97b15c1eb2c4aa41
Source of Spectrum JX-2015-6-1080
Wiley ID 1727963