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(S)-N-(2-Hydroxypropionyl)bornane-10,2-sultam benzoate
SpectraBase Compound ID 8dokr4cE4ng
InChI InChI=1S/C20H25NO5S/c1-13(26-18(23)14-7-5-4-6-8-14)17(22)21-16-11-15-9-10-20(16,19(15,2)3)12-27(21,24)25/h4-8,13,15-16H,9-12H2,1-3H3/t13-,15+,16?,20+/m0/s1
InChIKey ZUEFWLTYPMZWKK-VVFSEIMASA-N
Mol Weight 391.48 g/mol
Molecular Formula C20H25NO5S
Exact Mass 391.145344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DH1s1fUEfTC
Name (S)-N-(2-Hydroxypropionyl)bornane-10,2-sultam benzoate
Alternate Name(s) 2-(10,10-dimethyl-3,3-dioxido-3-thia-4-azatricyclo[5.2.1.0(1,5)]dec-4-yl)-1-methyl-2-oxoethyl benzoate Benzoic acid (S)-2-(10,10-dimethyl-3,3-dioxo-3lambda*6*-thia-4-aza-tricyclo[5.2.1.0*1,5*]dec-4-yl)-1-methyl-2-oxo-ethyl ester
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Formula C20H25NO5S
InChI InChI=1S/C20H25NO5S/c1-13(26-18(23)14-7-5-4-6-8-14)17(22)21-16-11-15-9-10-20(16,19(15,2)3)12-27(21,24)25/h4-8,13,15-16H,9-12H2,1-3H3/t13-,15+,16?,20+/m0/s1
InChIKey ZUEFWLTYPMZWKK-VVFSEIMASA-N
Molecular Weight 391.482 g/mol
SMILES C12N(S(C[C@@]11C([C@@](C2)(CC1)[H])(C)C)(=O)=O)C([C@@](OC(=O)c1ccccc1)(C)[H])=O
SPLASH splash10-0a4i-0900000000-fdefabd638d7d2dbbaec
Source of Spectrum QC-6-493-20
Wiley ID 868715