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(+)-(1R,4aR,7aR)-4a-(tert-Butoxycarbonylamino)-3-oxooctahydrocyclopenta[c]pyran-1-carboxylic acid
SpectraBase Compound ID DuTjDqyUXw8
InChI InChI=1S/C14H21NO6/c1-13(2,3)21-12(19)15-14-6-4-5-8(14)10(11(17)18)20-9(16)7-14/h8,10H,4-7H2,1-3H3,(H,15,19)(H,17,18)/t8-,10+,14+/m0/s1
InChIKey RGUSQKCFFFRADG-LLHLLMPMSA-N
Mol Weight 299.32 g/mol
Molecular Formula C14H21NO6
Exact Mass 299.136887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HTvTXRObZB8
Name (+)-(1R,4aR,7aR)-4a-(tert-Butoxycarbonylamino)-3-oxooctahydrocyclopenta[c]pyran-1-carboxylic acid
Alternate Name(s) (1R,4aR,7aR)-4a-((tert-butoxycarbonyl)amino)-3-oxooctahydrocyclopenta[c]pyran-1-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H21NO6
InChI InChI=1S/C14H21NO6/c1-13(2,3)21-12(19)15-14-6-4-5-8(14)10(11(17)18)20-9(16)7-14/h8,10H,4-7H2,1-3H3,(H,15,19)(H,17,18)/t8-,10+,14+/m0/s1
InChIKey RGUSQKCFFFRADG-LLHLLMPMSA-N
Literature Reference DOI 10.1021/ol063082q
Molecular Weight 299.323 g/mol
SMILES OC([C@]1([C@]2([C@](CC(O1)=O)(CCC2)NC(OC(C)(C)C)=O)[H])[H])=O
SPLASH splash10-0a4l-9430000000-72622e7696d6c835dde9
Source of Spectrum A1-9-1231/SMS4-18
Wiley ID 1757909