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2-[(2S)-2-(Bromomethyl)pyrrolidin-1-yl]-1,3-benzothiazole
SpectraBase Compound ID Ep8jZpwoVfc
InChI InChI=1S/C12H13BrN2S/c13-8-9-4-3-7-15(9)12-14-10-5-1-2-6-11(10)16-12/h1-2,5-6,9H,3-4,7-8H2/t9-/m0/s1
InChIKey AAPPUCGGICHHPG-VIFPVBQESA-N
Mol Weight 297.21 g/mol
Molecular Formula C12H13BrN2S
Exact Mass 295.998283 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ORrndqbcfd
Name 2-[(2S)-2-(Bromomethyl)pyrrolidin-1-yl]-1,3-benzothiazole
Alternate Name(s) (S)-2-(2-(bromomethyl)pyrrolidin-1-yl)benzo[d]thiazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13BrN2S
InChI InChI=1S/C12H13BrN2S/c13-8-9-4-3-7-15(9)12-14-10-5-1-2-6-11(10)16-12/h1-2,5-6,9H,3-4,7-8H2/t9-/m0/s1
InChIKey AAPPUCGGICHHPG-VIFPVBQESA-N
Molecular Weight 297.214 g/mol
SMILES c1(sc2c(n1)cccc2)N1[C@@](CCC1)(CBr)[H]
SPLASH splash10-0udi-0090000000-95012d0a35934ded3718
Source of Spectrum H-95-2186-(S)_9
Wiley ID 1784243