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2-Naphthalenecarboxylic acid 3-pentyl ester
SpectraBase Compound ID LNZzaLoWK9O
InChI InChI=1S/C16H18O2/c1-3-15(4-2)18-16(17)14-10-9-12-7-5-6-8-13(12)11-14/h5-11,15H,3-4H2,1-2H3
InChIKey HHMYJBZPWGCMBE-UHFFFAOYSA-N
Mol Weight 242.32 g/mol
Molecular Formula C16H18O2
Exact Mass 242.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2nN4gTwnftI
Name 2-Naphthalenecarboxylic acid 3-pentyl ester
Classification Designer drug side product
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 242.130679818 u
Formula C16H18O2
InChI InChI=1S/C16H18O2/c1-3-15(4-2)18-16(17)14-10-9-12-7-5-6-8-13(12)11-14/h5-11,15H,3-4H2,1-2H3
InChIKey HHMYJBZPWGCMBE-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 242.318 g/mol
Nominal Mass 242 u
Quality 997
Retention Index 1927
SMILES C=12C(C=CC(C(OC(CC)CC)=O)=C2)=CC=CC1
SPLASH splash10-05fr-0900000000-dfea9e9a50a3f33040b6
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Pentan-3-yl-naphthalene-2-carboxylate
Technique GC/MS
Wiley ID DD2024_010240