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1-(2-n-Butyl-1-(4-methylphenyl)-4,5,6,7-tetrahydro-1H-indol-3-yl)ethanone
SpectraBase Compound ID Et5f4sipCnC
InChI InChI=1S/C21H27NO/c1-4-5-9-20-21(16(3)23)18-8-6-7-10-19(18)22(20)17-13-11-15(2)12-14-17/h11-14H,4-10H2,1-3H3
InChIKey SBFPZSVUYRCEJP-UHFFFAOYSA-N
Mol Weight 309.45 g/mol
Molecular Formula C21H27NO
Exact Mass 309.209264 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IVgtqnopBD4
Name 1-(2-n-Butyl-1-(4-methylphenyl)-4,5,6,7-tetrahydro-1H-indol-3-yl)ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H27NO
InChI InChI=1S/C21H27NO/c1-4-5-9-20-21(16(3)23)18-8-6-7-10-19(18)22(20)17-13-11-15(2)12-14-17/h11-14H,4-10H2,1-3H3
InChIKey SBFPZSVUYRCEJP-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol900522g
Molecular Weight 309.453 g/mol
SMILES c1(-[n]2c3c(c(c2CCCC)C(C)=O)CCCC3)ccc(C)cc1
SPLASH splash10-014i-0193000000-023f8b4c9f244a48f27f
Source of Spectrum A1-11-2031/SMS5-5p
Synonyms 1-(2-butyl-1-(p-tolyl)-4,5,6,7-tetrahydro-1H-indol-3-yl)ethanone
Wiley ID 1756751