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(+)-(3S,5R,8S)-3-Heptyl-5-methylpyrrolizidine
SpectraBase Compound ID LF8nGUxbPRu
InChI InChI=1S/C15H29N/c1-3-4-5-6-7-8-14-11-12-15-10-9-13(2)16(14)15/h13-15H,3-12H2,1-2H3/t13-,14+,15+/m1/s1
InChIKey HDOOWYGBFWMHAV-ILXRZTDVSA-N
Mol Weight 223.4 g/mol
Molecular Formula C15H29N
Exact Mass 223.23 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Xwa2Qf9fjX
Name (+)-(3S,5R,8S)-3-Heptyl-5-methylpyrrolizidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H29N
InChI InChI=1S/C15H29N/c1-3-4-5-6-7-8-14-11-12-15-10-9-13(2)16(14)15/h13-15H,3-12H2,1-2H3/t13-,14+,15+/m1/s1
InChIKey HDOOWYGBFWMHAV-ILXRZTDVSA-N
Literature Reference DOI 10.1002/adsc.201500781
Molecular Weight 223.404 g/mol
SMILES [C@]12(N([C@@](CC2)(C)[H])[C@](CC1)(CCCCCCC)[H])[H]
SPLASH splash10-00di-1900000000-ce0007f65692138454c4
Source of Spectrum ASC-358-450-(+)_(5Z,8E)_1
Synonyms (+)-xenovenine (3S,5R,7aS)-3-heptyl-5-methylhexahydro-1H-pyrrolizine
Wiley ID 1793220