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9-[(1R,2S,5R)-Menthoxycarbonyl]-2H-3,4-dihydro-[1,3]thiazino[6,5-b]indol-2,4-dione
SpectraBase Compound ID 9Bld58WWNPU
InChI InChI=1S/C21H24N2O4S/c1-11(2)13-9-8-12(3)10-16(13)27-21(26)23-15-7-5-4-6-14(15)17-18(24)22-20(25)28-19(17)23/h4-7,11-13,16H,8-10H2,1-3H3,(H,22,24,25)/t12-,13+,16-/m1/s1
InChIKey OPPBPXPIYQVNCE-DVOMOZLQSA-N
Mol Weight 400.49 g/mol
Molecular Formula C21H24N2O4S
Exact Mass 400.145678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8cWjy2VYoJK
Name 9-[(1R,2S,5R)-Menthoxycarbonyl]-2H-3,4-dihydro-[1,3]thiazino[6,5-b]indol-2,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24N2O4S
InChI InChI=1S/C21H24N2O4S/c1-11(2)13-9-8-12(3)10-16(13)27-21(26)23-15-7-5-4-6-14(15)17-18(24)22-20(25)28-19(17)23/h4-7,11-13,16H,8-10H2,1-3H3,(H,22,24,25)/t12-,13+,16-/m1/s1
InChIKey OPPBPXPIYQVNCE-DVOMOZLQSA-N
Molecular Weight 400.493 g/mol
SMILES N1C(c2c3c([n](c2SC1=O)C(O[C@]1([C@@](CC[C@](C1)(C)[H])(C(C)C)[H])[H])=O)cccc3)=O
SPLASH splash10-001i-9320100000-f3d531edc9e641c57fe4
Source of Spectrum F-69-1103-47
Synonyms (1R,2S,5R)-2-isopropyl-5-methylcyclohexyl 2,4-dioxo-3,4-dihydro-[1,3]thiazino[6,5-b]indole-9(2H)-carboxylate
Wiley ID 1737551