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Nicoboxil
SpectraBase Compound ID BB2eNo6h3gU
InChI InChI=1S/C12H17NO3/c1-2-3-7-15-8-9-16-12(14)11-5-4-6-13-10-11/h4-6,10H,2-3,7-9H2,1H3
InChIKey IZJRISIINLJVBU-UHFFFAOYSA-N
Mol Weight 223.27 g/mol
Molecular Formula C12H17NO3
Exact Mass 223.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8JWKn5MYt0q
Name Nicoboxil
Classification Rubefacient
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 223.120843408 u
Formula C12H17NO3
InChI InChI=1S/C12H17NO3/c1-2-3-7-15-8-9-16-12(14)11-5-4-6-13-10-11/h4-6,10H,2-3,7-9H2,1H3
InChIKey IZJRISIINLJVBU-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 223.272 g/mol
Nominal Mass 223 u
Quality 993
Retention Index 1699
SMILES C=1(C(OCCOCCCC)=O)C=NC=CC1
SPLASH splash10-0pb9-7900000000-7c59e3002a770d7bd194
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Nicoboxilo Nicoboxilum 2-Butoxyethylpyridine-3-carboxylate
Technique GC/MS
Wiley ID DD2024_012086