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7,15-bis(p-Tolylsulfonyl)-2,2-dimethyl-4,6,7,8,9,10,11,12,13,14,15,16-dodecahydro-17,5-(nitrilometheno)-1,3-dioxino[4,5-D][1,8]diazacyclopentadecine

View entire compound with spectra: 2 NMR, and 1 FTIR

7,15-bis(p-Tolylsulfonyl)-2,2-dimethyl-4,6,7,8,9,10,11,12,13,14,15,16-dodecahydro-17,5-(nitrilometheno)-1,3-dioxino[4,5-D][1,8]diazacyclopentadecine
SpectraBase Compound ID BMTmFSuspQu
InChI InChI=1S/C32H41N3O6S2/c1-24-10-14-27(15-11-24)42(36,37)34-18-8-6-5-7-9-19-35(43(38,39)28-16-12-25(2)13-17-28)22-30-31-29(26(21-34)20-33-30)23-40-32(3,4)41-31/h10-17,20H,5-9,18-19,21-23H2,1-4H3
InChIKey KDLNSZFICKVAGV-UHFFFAOYSA-N
Mol Weight 627.8 g/mol
Molecular Formula C32H41N3O6S2
Exact Mass 627.243678 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID JctV8pur5MN
Name 7,15-BIS(p-TOLYLSULFONYL)-2,2-DIMETHYL-4,6,7,8,9,10,11,12,13,14,15,16-DODECAHYDRO-17,5-(NITRILOMETHENO)-1,3-DIOXINO-[4,5-d][1,8]DIAZACYCLOPENTADECINE
Source of Sample M. Iwata, the Institute of Physical and Chemical Research, Saitama, Japan
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H41N3O6S2
InChI InChI=1S/C32H41N3O6S2/c1-24-10-14-27(15-11-24)42(36,37)34-18-8-6-5-7-9-19-35(43(38,39)28-16-12-25(2)13-17-28)22-30-31-29(26(21-34)20-33-30)23-40-32(3,4)41-31/h10-17,20H,5-9,18-19,21-23H2,1-4H3
InChIKey KDLNSZFICKVAGV-UHFFFAOYSA-N
Literature Reference J. ORG. CHEM. 48, 1282(1983) Abstract-Chemical Abstracts= 98, 160688(1983)
Melting Point 224-226C
Molecular Weight 627.815002
Synonyms /NITRILOMETHENO/-1,3-DIOXINO/4,5-D/- /1,8/DIAZACYCLOPENTADECINE, 17,5-, 7,15-BIS/P-TOLYLSULFONYL/-2,2-DIMETHYL- 4,6,7,8,9,10,11,12,13,14,15,16-DODECA- HYDRO-,
Technique KBr WAFER