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cis-3-acetoxy-4-benzoxycarbonylamino-1-thia-cyclopentane
SpectraBase Compound ID 8qtgz6VwW1v
InChI InChI=1S/C14H17NO4S/c1-10(16)19-13-9-20-8-12(13)15-14(17)18-7-11-5-3-2-4-6-11/h2-6,12-13H,7-9H2,1H3,(H,15,17)/t12-,13+/m1/s1
InChIKey MNSVPPAPLVHRFH-OLZOCXBDSA-N
Mol Weight 295.35 g/mol
Molecular Formula C14H17NO4S
Exact Mass 295.087829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID NS3GLfXXYe
Name cis-3-acetoxy-4-benzoxycarbonylamino-1-thia-cyclopentane
Alternate Name(s) (3R,4S)-4-{[(benzyloxy)carbonyl]amino}tetrahydro-3-thienyl acetate
Comments Less than 3 mono-isotopic peaks
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Formula C14H17NO4S
InChI InChI=1S/C14H17NO4S/c1-10(16)19-13-9-20-8-12(13)15-14(17)18-7-11-5-3-2-4-6-11/h2-6,12-13H,7-9H2,1H3,(H,15,17)/t12-,13+/m1/s1
InChIKey MNSVPPAPLVHRFH-OLZOCXBDSA-N
Molecular Weight 295.353 g/mol
SMILES N(C(=O)OCc1ccccc1)[C@]1([C@@](OC(=O)C)(CSC1)[H])[H]
SPLASH splash10-0006-0920000000-29904298b731515e061e
Source of Spectrum HC-12-392-0
Wiley ID 1298047