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1H-Pyrrolizin-1-ol, hexahydro-2-mercapto-, (1.alpha.,2.beta.,7a.beta.)-(.+-.)-
SpectraBase Compound ID 4n3WPjSEhzR
InChI InChI=1S/C7H13NOS/c9-7-5-2-1-3-8(5)4-6(7)10/h5-7,9-10H,1-4H2/t5-,6+,7+/m1/s1
InChIKey SQYSCCIZQKUKFE-VQVTYTSYSA-N
Mol Weight 159.25 g/mol
Molecular Formula C7H13NOS
Exact Mass 159.071785 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LCAjfqIPnGQ
Name 1H-Pyrrolizin-1-ol, hexahydro-2-mercapto-, (1.alpha.,2.beta.,7a.beta.)-(.+-.)-
CAS Registry Number 78739-21-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H13NOS
InChI InChI=1S/C7H13NOS/c9-7-5-2-1-3-8(5)4-6(7)10/h5-7,9-10H,1-4H2/t5-,6+,7+/m1/s1
InChIKey SQYSCCIZQKUKFE-VQVTYTSYSA-N
Molecular Weight 159.247 g/mol
SMILES O[C@]1([C@@]2(N(C[C@@]1(S)[H])CCC2)[H])[H]
SPLASH splash10-00di-9200000000-1f0321d006b7a2576b36
Source of Spectrum I-59-1104-0
Synonyms (1S,2S,7aR)-2-sulfanylhexahydro-1H-pyrrolo[1,2-a]pyrrol-1-ol 1.beta.-hydroxy-2.alpha.-mercaptopyrrolizidine
Wiley ID 1156056