| SpectraBase Compound ID | 1dAE0YN4dNr |
|---|---|
| InChI | InChI=1S/C32H46N4O7/c1-4-20(2)28-32(41)36-17-9-8-11-25(36)31(40)33-23(10-6-5-7-12-26(37)27-19-43-27)29(38)34-24(30(39)35-28)18-21-13-15-22(42-3)16-14-21/h13-16,20,23-25,27-28H,4-12,17-19H2,1-3H3,(H,33,40)(H,34,38)(H,35,39) |
| InChIKey | WANLLPADDCXPGO-UHFFFAOYSA-N |
| Mol Weight | 598.7 g/mol |
| Molecular Formula | C32H46N4O7 |
| Exact Mass | 598.33665 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Eewh8cZswRz |
|---|---|
| Name | Cyl-2 |
| Alternate Name(s) | 3-Butan-2-yl-6-[(4-methoxyphenyl)methyl]-9-[6-(2-oxiranyl)-6-oxohexyl]-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone 3-Butan-2-yl-6-[(4-methoxyphenyl)methyl]-9-[6-(oxiran-2-yl)-6-oxohexyl]-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone 3-Butan-2-yl-6-[(4-methoxyphenyl)methyl]-9-[6-oxidanylidene-6-(oxiran-2-yl)hexyl]-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone 6-[(4-methoxyphenyl)methyl]-9-[6-(oxiran-2-yl)-6-oxo-hexyl]-3-sec-butyl-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone 9-[6-keto-6-(oxiran-2-yl)hexyl]-6-p-anisyl-3-sec-butyl-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-diquinone |
| CAS Registry Number | 42002-26-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C32H46N4O7 |
| InChI | InChI=1S/C32H46N4O7/c1-4-20(2)28-32(41)36-17-9-8-11-25(36)31(40)33-23(10-6-5-7-12-26(37)27-19-43-27)29(38)34-24(30(39)35-28)18-21-13-15-22(42-3)16-14-21/h13-16,20,23-25,27-28H,4-12,17-19H2,1-3H3,(H,33,40)(H,34,38)(H,35,39) |
| InChIKey | WANLLPADDCXPGO-UHFFFAOYSA-N |
| Molecular Weight | 598.741 g/mol |
| SMILES | N1C(C2CCCCN2C(C(C(C)CC)NC(C(Cc2ccc(cc2)OC)NC(C1CCCCCC(C1CO1)=O)=O)=O)=O)=O |
| SPLASH | splash10-0089-9832130000-f7a3c95a62590304623d |
| Source of Spectrum | BS-1-10-0 |
| Wiley ID | 1409958 |