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N-(4-Propylbenzyl)-2-[4-ethyl-2-methoxy-5-methylthiophenyl]ethan-1-amine
SpectraBase Compound ID GEIMm73EbNG
InChI InChI=1S/C22H31NOS/c1-5-7-17-8-10-18(11-9-17)16-23-13-12-20-15-22(25-4)19(6-2)14-21(20)24-3/h8-11,14-15,23H,5-7,12-13,16H2,1-4H3
InChIKey HUMBNKAVCXASCI-UHFFFAOYSA-N
Mol Weight 357.56 g/mol
Molecular Formula C22H31NOS
Exact Mass 357.212636 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DmSgkeoaW00
Name N-(4-Propylbenzyl)-2-[4-ethyl-2-methoxy-5-methylthiophenyl]ethan-1-amine
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 357.212635795 u
Formula C22H31NOS
InChI InChI=1S/C22H31NOS/c1-5-7-17-8-10-18(11-9-17)16-23-13-12-20-15-22(25-4)19(6-2)14-21(20)24-3/h8-11,14-15,23H,5-7,12-13,16H2,1-4H3
InChIKey HUMBNKAVCXASCI-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 357.556 g/mol
Nominal Mass 357 u
Quality 990
Retention Index 2647
SMILES C=1(C(=CC(=C(C1)SC)CC)OC)CCNCC=1C=CC(=CC1)CCC
SPLASH splash10-001i-0900000000-89a2107a2062876ac85e
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Wiley ID DD2024_023618