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7-(tert-Butyloxycarbonyloxymethyl)-1-tosyl-3-methylene-3a,7a-dihydro-7H-pyrrolo[2,3-c]pyran
SpectraBase Compound ID LrR8tpYdU6S
InChI InChI=1S/C21H27NO6S/c1-14-6-8-16(9-7-14)29(24,25)22-12-15(2)17-10-11-26-18(19(17)22)13-27-20(23)28-21(3,4)5/h6-11,17-19H,2,12-13H2,1,3-5H3/t17?,18-,19?/m1/s1
InChIKey DWASKOPIGBMRCF-JLAWEPINSA-N
Mol Weight 421.51 g/mol
Molecular Formula C21H27NO6S
Exact Mass 421.155909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9MWuIXkwbEH
Name 7-(tert-Butyloxycarbonyloxymethyl)-1-tosyl-3-methylene-3a,7a-dihydro-7H-pyrrolo[2,3-c]pyran
Alternate Name(s) (S)-7-(tert-Butyloxycarbonyloxymethyl)-1-tosyl-3-methylene-3a,7a-dihydro-7H-pyrrolo[2,3-c]pyran tert-butyl {3-methylene-1-[(4-methylphenyl)sulfonyl]-1,2,3,3a,7,7a-hexahydropyrano[3,4-b]pyrrol-7-yl}methyl carbonate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H27NO6S
InChI InChI=1S/C21H27NO6S/c1-14-6-8-16(9-7-14)29(24,25)22-12-15(2)17-10-11-26-18(19(17)22)13-27-20(23)28-21(3,4)5/h6-11,17-19H,2,12-13H2,1,3-5H3/t17?,18-,19?/m1/s1
InChIKey DWASKOPIGBMRCF-JLAWEPINSA-N
Molecular Weight 421.508 g/mol
SMILES C12N(S(c3ccc(cc3)C)(=O)=O)CC(C1C=CO[C@@]2(COC(OC(C)(C)C)=O)[H])=C
SPLASH splash10-014i-0090000000-cbdd987d0382fdc4348b
Source of Spectrum AT-32-2164-18
Wiley ID 835913