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isopropyl 2-(4,5,6,7-tetrahydro-1H-indol-2-yl)pentanoate

View entire compound with spectra: 1 MS (GC)

isopropyl 2-(4,5,6,7-tetrahydro-1H-indol-2-yl)pentanoate
SpectraBase Compound ID BxUDzy2HBXF
InChI InChI=1S/C16H25NO2/c1-4-7-13(16(18)19-11(2)3)15-10-12-8-5-6-9-14(12)17-15/h10-11,13,17H,4-9H2,1-3H3
InChIKey PBOUMNDUGSYVLE-UHFFFAOYSA-N
Mol Weight 263.38 g/mol
Molecular Formula C16H25NO2
Exact Mass 263.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID kRtnwkW1mY
Name isopropyl 2-(4,5,6,7-tetrahydro-1H-indol-2-yl)pentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H25NO2
InChI InChI=1S/C16H25NO2/c1-4-7-13(16(18)19-11(2)3)15-10-12-8-5-6-9-14(12)17-15/h10-11,13,17H,4-9H2,1-3H3
InChIKey PBOUMNDUGSYVLE-UHFFFAOYSA-N
Literature Reference DOI 10.1039/C6RA05348C
Molecular Weight 263.381 g/mol
SMILES [nH]1c(cc2c1CCCC2)C(CCC)C(OC(C)C)=O
SPLASH splash10-004i-0920000000-4c6245804ef5f7482fd0
Source of Spectrum RSA-6-44341/SM5-6cd
Wiley ID 1807200