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(3R,5S)-5-methyl-3-nonyl-2,3,5,6,7,8,9,9a-octahydro-1H-pyrrolo[1,2-a]azepine
SpectraBase Compound ID 7IzNs3a5FJT
InChI InChI=1S/C19H37N/c1-3-4-5-6-7-8-9-13-18-15-16-19-14-11-10-12-17(2)20(18)19/h17-19H,3-16H2,1-2H3/t17-,18+,19?/m0/s1
InChIKey DQLBFLCLHKVGLT-PAMZHZACSA-N
Mol Weight 279.5 g/mol
Molecular Formula C19H37N
Exact Mass 279.2926 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ri5hPR60Qz
Name (3R,5S)-5-methyl-3-nonyl-2,3,5,6,7,8,9,9a-octahydro-1H-pyrrolo[1,2-a]azepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H37N
InChI InChI=1S/C19H37N/c1-3-4-5-6-7-8-9-13-18-15-16-19-14-11-10-12-17(2)20(18)19/h17-19H,3-16H2,1-2H3/t17-,18+,19?/m0/s1
InChIKey DQLBFLCLHKVGLT-PAMZHZACSA-N
Instrument Name Shimadzu QP-5000 GC-MS
Ionization Type EI
Literature Reference DOI 10.1021/np0005098
Molecular Weight 279.512 g/mol
SMILES C1CC[C@@](N2C(C1)CC[C@]2(CCCCCCCCC)[H])(C)[H]
SPLASH splash10-0udi-0900000000-e52f32994dbb543dc443
Source of Spectrum G4-64-SM3-2c
Wiley ID 1883110