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[3S-(3.beta.,3a.beta.,6.alpha.,6a.beta.)-3-butylhexahydrothieno[3,2-c]-isoxazol-6-yl carbamic acid methyl ester
SpectraBase Compound ID 4fvbn1bOtzU
InChI InChI=1S/C11H20N2O3S/c1-3-4-5-8-10-9(13-16-8)7(6-17-10)12-11(14)15-2/h7-10,13H,3-6H2,1-2H3,(H,12,14)/t7-,8-,9-,10-/m1/s1
InChIKey UELXSVAVBORQFS-ZYUZMQFOSA-N
Mol Weight 260.35 g/mol
Molecular Formula C11H20N2O3S
Exact Mass 260.119464 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9kkMLCo59wg
Name [3S-(3.beta.,3a.beta.,6.alpha.,6a.beta.)-3-butylhexahydrothieno[3,2-c]-isoxazol-6-yl carbamic acid methyl ester
CAS Registry Number 115587-49-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20N2O3S
InChI InChI=1S/C11H20N2O3S/c1-3-4-5-8-10-9(13-16-8)7(6-17-10)12-11(14)15-2/h7-10,13H,3-6H2,1-2H3,(H,12,14)/t7-,8-,9-,10-/m1/s1
InChIKey UELXSVAVBORQFS-ZYUZMQFOSA-N
Molecular Weight 260.352 g/mol
SMILES N1O[C@@]([C@@]2([C@]1([C@@](CS2)(NC(=O)OC)[H])[H])[H])(CCCC)[H]
SPLASH splash10-0udi-0900000000-ca6d9c8c32eccde6b543
Source of Spectrum F-43-4897-11
Synonyms Methyl (3R,3aS,6S,6aR)-3-butylhexahydrothieno[3,2-c]isoxazol-6-ylcarbamate
Wiley ID 1263261