| SpectraBase Spectrum ID |
8cucKpTODV9 |
| Name |
1-Phenyl-4,7,10-tri(t-butyloxycarbonyl)-1,4,7,10-tetraazacyclododecane |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H48N4O6 |
| InChI |
InChI=1S/C29H48N4O6/c1-27(2,3)37-24(34)31-17-15-30(23-13-11-10-12-14-23)16-18-32(25(35)38-28(4,5)6)20-22-33(21-19-31)26(36)39-29(7,8)9/h10-14H,15-22H2,1-9H3 |
| InChIKey |
NQXKJHLOFKITPA-UHFFFAOYSA-N |
| Molecular Weight |
548.725 g/mol |
| SMILES |
C(N1CCN(C(OC(C)(C)C)=O)CCN(C(OC(C)(C)C)=O)CCN(CC1)c1ccccc1)(OC(C)(C)C)=O |
| SPLASH |
splash10-052b-6000090000-6eb538b97f62c2f7ce6c |
| Source of Spectrum |
SO-0-1823-6 |
| Synonyms |
tri(tert-butyl) 10-phenyl-1,4,7,10-tetraazacyclododecane-1,4,7-tricarboxylate |
| Wiley ID |
878721 |
