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4-Benzyloxy-3-nitromethyl-pentanoic acid, methyl ester
SpectraBase Compound ID 8aflZXw9jgs
InChI InChI=1S/C14H19NO5/c1-11(20-10-12-6-4-3-5-7-12)13(9-15(17)18)8-14(16)19-2/h3-7,11,13H,8-10H2,1-2H3
InChIKey MCDQHESIZZEWFI-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 5SbixSJT5bB
Name 4-BENZYLOXY-3-NITROMETHYLPENTANOIC ACID, METHYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H19NO5
InChI InChI=1S/C14H19NO5/c1-11(20-10-12-6-4-3-5-7-12)13(9-15(17)18)8-14(16)19-2/h3-7,11,13H,8-10H2,1-2H3
InChIKey MCDQHESIZZEWFI-UHFFFAOYSA-N
Molecular Weight 281.1258
SMILES c1cccc(COC(C(CN(=O)=O)CC(=O)OC)C)c1
SPLASH splash10-0006-9200000000-41b16c7fc6069b7e3654
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany