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cis-2-Methyl-2-[4-(5-n-nonyl-2-pyrrolidyl)butyl]-1,3-dioxolane
SpectraBase Compound ID EJPp6YcxmnA
InChI InChI=1S/C21H41NO2/c1-3-4-5-6-7-8-9-12-19-14-15-20(22-19)13-10-11-16-21(2)23-17-18-24-21/h19-20,22H,3-18H2,1-2H3/t19-,20+/m0/s1
InChIKey PSKANIRUBCRCDV-VQTJNVASSA-N
Mol Weight 339.6 g/mol
Molecular Formula C21H41NO2
Exact Mass 339.31373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6jMiH5muk1P
Name cis-2-Methyl-2-[4-(5-n-nonyl-2-pyrrolidyl)butyl]-1,3-dioxolane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H41NO2
InChI InChI=1S/C21H41NO2/c1-3-4-5-6-7-8-9-12-19-14-15-20(22-19)13-10-11-16-21(2)23-17-18-24-21/h19-20,22H,3-18H2,1-2H3/t19-,20+/m0/s1
InChIKey PSKANIRUBCRCDV-VQTJNVASSA-N
Instrument Name Shimadzu QP-5000 GC-MS
Ionization Type EI
Literature Reference DOI 10.1021/np0005098
Molecular Weight 339.564 g/mol
SMILES N1[C@@](CC[C@@]1(CCCCCCCCC)[H])(CCCCC1(C)OCCO1)[H]
SPLASH splash10-0016-9110000000-ae4936c79a0fda7611bf
Sample Comments Cis isomer
Source of Spectrum G4-64-425-7a
Wiley ID 1883103