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Tetrahydropyrrolo[2,1-a](1,4,7,10,13-pentaazocyclopentadecane-2,5,8,11,14-pentaone), 4,7-dimethyl-9-diphenylmethylthio)methyl-

View entire compound with spectra: 2 MS (GC)

Tetrahydropyrrolo[2,1-a](1,4,7,10,13-pentaazocyclopentadecane-2,5,8,11,14-pentaone), 4,7-dimethyl-9-diphenylmethylthio)methyl-
SpectraBase Compound ID 81Xyl5Rd2hy
InChI InChI=1S/C29H35N5O5S/c1-32-18-26(37)34-15-9-14-23(34)28(38)30-16-24(35)31-22(29(39)33(2)17-25(32)36)19-40-27(20-10-5-3-6-11-20)21-12-7-4-8-13-21/h3-8,10-13,22-23,27H,9,14-19H2,1-2H3,(H,30,38)(H,31,35)
InChIKey YVMSPZKZIVBVPY-UHFFFAOYSA-N
Mol Weight 565.7 g/mol
Molecular Formula C29H35N5O5S
Exact Mass 565.23589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 45qGFJcH3wa
Name
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Formula C29H35N5O5S
InChI InChI=1S/C29H35N5O5S/c1-32-18-26(37)34-15-9-14-23(34)28(38)30-16-24(35)31-22(29(39)33(2)17-25(32)36)19-40-27(20-10-5-3-6-11-20)21-12-7-4-8-13-21/h3-8,10-13,22-23,27H,9,14-19H2,1-2H3,(H,30,38)(H,31,35)
InChIKey YVMSPZKZIVBVPY-UHFFFAOYSA-N
Molecular Weight 565.2351
SMILES N1C(C2CCCN2C(CN(C(CN(C(C(CSC(c2ccccc2)c2ccccc2)NC(=O)C1)=O)C)=O)C)=O)=O
SPLASH splash10-014i-5912000000-bbeee001d261d572aa9d
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany