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(R)-4,9-Dimethyl-6-[(1S)-1-methyl-2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl-3,4,5,6,7,8,9,10-octahydro-dinaphtho[2,1-f:1',2'-h][1,2,4,11]tetrazacyclododecine-5,8-dione

View entire compound with spectra: 1 MS (GC)

(R)-4,9-Dimethyl-6-[(1S)-1-methyl-2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl-3,4,5,6,7,8,9,10-octahydro-dinaphtho[2,1-f:1',2'-h][1,2,4,11]tetrazacyclododecine-5,8-dione
SpectraBase Compound ID KEiwVGk33RY
InChI InChI=1S/C32H31N5O5/c1-20(29(38)36-16-17-42-32(36)41)37-31(40)35(3)19-24-15-13-22-9-5-7-11-26(22)28(24)27-23(18-34(2)30(39)33-37)14-12-21-8-4-6-10-25(21)27/h4-15,20H,16-19H2,1-3H3,(H,33,39)/t20-/m0/s1
InChIKey RUTOMLKUHDCBIT-FQEVSTJZSA-N
Mol Weight 565.6 g/mol
Molecular Formula C32H31N5O5
Exact Mass 565.232519 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cg2MCssV29H
Name (R)-4,9-Dimethyl-6-[(1S)-1-methyl-2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl-3,4,5,6,7,8,9,10-octahydro-dinaphtho[2,1-f:1',2'-h][1,2,4,11]tetrazacyclododecine-5,8-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H31N5O5
InChI InChI=1S/C32H31N5O5/c1-20(29(38)36-16-17-42-32(36)41)37-31(40)35(3)19-24-15-13-22-9-5-7-11-26(22)28(24)27-23(18-34(2)30(39)33-37)14-12-21-8-4-6-10-25(21)27/h4-15,20H,16-19H2,1-3H3,(H,33,39)/t20-/m0/s1
InChIKey RUTOMLKUHDCBIT-FQEVSTJZSA-N
Molecular Weight 565.630 g/mol
SMILES N1C(N(Cc2c(-c3c(CN(C(N1[C@](C(N1C(OCC1)=O)=O)(C)[H])=O)C)ccc1ccccc31)c1ccccc1cc2)C)=O
SPLASH splash10-0006-0095320000-a86c58b59266a0751909
Source of Spectrum KC-0-2672-14
Wiley ID 786672