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Ethyl 2-(1-hydroxyethyl)-4-nitro-3-phenylbutanoate
SpectraBase Compound ID AefcH8DMZEp
InChI InChI=1S/C14H19NO5/c1-3-20-14(17)13(10(2)16)12(9-15(18)19)11-7-5-4-6-8-11/h4-8,10,12-13,16H,3,9H2,1-2H3
InChIKey OFVCVTXPACKMDM-UHFFFAOYSA-N
Mol Weight 281.31 g/mol
Molecular Formula C14H19NO5
Exact Mass 281.126323 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E2paVaN3ooY
Name Ethyl 2-(1-hydroxyethyl)-4-nitro-3-phenylbutanoate
Alternate Name(s) 2-(1-hydroxyethyl)-4-nitro-3-phenyl-butyric acid ethyl ester 2-(1-hydroxyethyl)-4-nitro-3-phenylbutanoic acid ethyl ester Benzenepropanoic acid, .alpha.-(1-hydroxyethyl)-.beta.-(nitromethyl)-, ethyl ester
CAS Registry Number 33872-15-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H19NO5
InChI InChI=1S/C14H19NO5/c1-3-20-14(17)13(10(2)16)12(9-15(18)19)11-7-5-4-6-8-11/h4-8,10,12-13,16H,3,9H2,1-2H3
InChIKey OFVCVTXPACKMDM-UHFFFAOYSA-N
Molecular Weight 281.308 g/mol
SMILES OC(C(C(c1ccccc1)CN(=O)=O)C(=O)OCC)C
SPLASH splash10-0006-2900000000-1aaf7e54b75aa2b4d1f4
Wiley ID 1485894