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[3-allyl-5-methyl-1-(p-tolylsulfonyl)pyrrolidin-3-yl]methanol
SpectraBase Compound ID IHztAZTsJnx
InChI InChI=1S/C16H23NO3S/c1-4-9-16(12-18)10-14(3)17(11-16)21(19,20)15-7-5-13(2)6-8-15/h4-8,14,18H,1,9-12H2,2-3H3
InChIKey DZUQSAUNLZRDAT-UHFFFAOYSA-N
Mol Weight 309.42 g/mol
Molecular Formula C16H23NO3S
Exact Mass 309.139865 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JvUbssovOHM
Name [3-allyl-5-methyl-1-(p-tolylsulfonyl)pyrrolidin-3-yl]methanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23NO3S
InChI InChI=1S/C16H23NO3S/c1-4-9-16(12-18)10-14(3)17(11-16)21(19,20)15-7-5-13(2)6-8-15/h4-8,14,18H,1,9-12H2,2-3H3
InChIKey DZUQSAUNLZRDAT-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS QP-5050A
Ionization Type EI
Molecular Weight 309.424 g/mol
SMILES OCC1(CC(N(C1)S(c1ccc(cc1)C)(=O)=O)C)CC=C
SPLASH splash10-052f-8900000000-51cbd6517956b7d72f1b
Sample Comments minor
Source of Spectrum JP5017644B2
Wiley ID 1852248