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3-(2-methylbutyl)-1H-indole
SpectraBase Compound ID 5dSeeCXI8bg
InChI InChI=1S/C13H17N/c1-3-10(2)8-11-9-14-13-7-5-4-6-12(11)13/h4-7,9-10,14H,3,8H2,1-2H3
InChIKey LWKYZEFHDCGBEF-UHFFFAOYSA-N
Mol Weight 187.29 g/mol
Molecular Formula C13H17N
Exact Mass 187.1361 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5SVKCTaR92p
Name 3-(2-methylbutyl)-1H-indole
CAS Registry Number 71711-21-2
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17N
InChI InChI=1S/C13H17N/c1-3-10(2)8-11-9-14-13-7-5-4-6-12(11)13/h4-7,9-10,14H,3,8H2,1-2H3
InChIKey LWKYZEFHDCGBEF-UHFFFAOYSA-N
Molecular Weight 187.286 g/mol
SMILES [nH]1c2c(c(c1)CC(CC)C)cccc2
SPLASH splash10-001i-0900000000-75df869fc834deae5a52
Source of Spectrum Y-16-670-0
Wiley ID 1184025