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Methyl 2-Benzyl-8-oxoazocane-2-carboxylate

View entire compound with spectra: 1 MS (GC)

Methyl 2-Benzyl-8-oxoazocane-2-carboxylate
SpectraBase Compound ID 3aPR2Edn5Kl
InChI InChI=1S/C16H21NO3/c1-20-15(19)16(12-13-8-4-2-5-9-13)11-7-3-6-10-14(18)17-16/h2,4-5,8-9H,3,6-7,10-12H2,1H3,(H,17,18)
InChIKey QRKMBPMAIPQYNG-UHFFFAOYSA-N
Mol Weight 275.35 g/mol
Molecular Formula C16H21NO3
Exact Mass 275.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B7Tt0EC4llt
Name Methyl 2-Benzyl-8-oxoazocane-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21NO3
InChI InChI=1S/C16H21NO3/c1-20-15(19)16(12-13-8-4-2-5-9-13)11-7-3-6-10-14(18)17-16/h2,4-5,8-9H,3,6-7,10-12H2,1H3,(H,17,18)
InChIKey QRKMBPMAIPQYNG-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo300887u
Molecular Weight 275.348 g/mol
SMILES N1C(CCCCCC1(C(=O)OC)Cc1ccccc1)=O
SPLASH splash10-0a4i-9800000000-e79a7b06d61f7beb1dc3
Source of Spectrum J-77-6093-3e
Wiley ID 1745167