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4-Heptadecyl-4-nitro-pimelic acid dimethyl ester
SpectraBase Compound ID EGw4R77yoVA
InChI InChI=1S/C26H49NO6/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-26(27(30)31,22-19-24(28)32-2)23-20-25(29)33-3/h4-23H2,1-3H3
InChIKey SUZKKHGKWSOOSZ-UHFFFAOYSA-N
Mol Weight 471.7 g/mol
Molecular Formula C26H49NO6
Exact Mass 471.355988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FMrUpNa47c
Name 4-Heptadecyl-4-nitro-pimelic acid dimethyl ester
Alternate Name(s) 4-Heptadecyl-4-nitroheptanedioic acid dimethyl ester Dimethyl 4-heptadecyl-4-nitro-heptanedioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H49NO6
InChI InChI=1S/C26H49NO6/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-26(27(30)31,22-19-24(28)32-2)23-20-25(29)33-3/h4-23H2,1-3H3
InChIKey SUZKKHGKWSOOSZ-UHFFFAOYSA-N
Molecular Weight 471.679 g/mol
SMILES C(N(=O)=O)(CCC(=O)OC)(CCC(=O)OC)CCCCCCCCCCCCCCCCC
SPLASH splash10-0006-2609100000-dae7e509edb8f6c707c1
Source of Spectrum SO-0-455-7
Wiley ID 864224