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Carbamic acid, (3-butylhexahydrothieno[3,2-c]isoxazol-6-yl)-, methyl ester, [3R-(3.alpha.,3a.alpha.,6.alpha.,6a.alpha.)]-
SpectraBase Compound ID LLWQbVvR6uj
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+/m0/s1
InChIKey UELXSVAVBORQFS-SGIHWFKDSA-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 9b2se0dRXkr
Name Carbamic acid, (3-butylhexahydrothieno[3,2-c]isoxazol-6-yl)-, methyl ester, [3R-(3.alpha.,3a.alpha.,6.alpha.,6a.alpha.)]-
CAS Registry Number 115587-48-9
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+/m0/s1
InChIKey UELXSVAVBORQFS-SGIHWFKDSA-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-0900000000-5a6d0a64dfd8fae2c5e3
Source of Spectrum F-43-4898-10
Synonyms Thieno[3,2-c]isoxazole, carbamic acid deriv. Methyl (3R,3aS,6R,6aR)-3-butylhexahydrothieno[3,2-c]isoxazol-6-ylcarbamate [3R-(3.alpha.,3a.alpha.,6.alpha.,6a.alpha.)]-3-butylhexahydrothieno-[3,2-c]isoxazol-6-yl carbamic acid methyl ester N-[(3R,3aS,6R,6aR)-3-butyl-1,3,3a,5,6,6a-hexahydrothieno[3,2-c]isoxazol-6-yl]carbamic acid methyl ester Methyl N-[(3R,3aS,6R,6aR)-3-butyl-1,3,3a,5,6,6a-hexahydrothieno[3,2-c]isoxazol-6-yl]carbamate Methyl N-[(3R,3aS,6R,6aR)-3-butyl-1,3,3a,5,6,6a-hexahydrothieno[3,2-c][1,2]oxazol-6-yl]carbamate
Wiley ID 1263263