SpectraBase Compound ID | D2xtVFd7hny |
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InChI | InChI=1S/C23H32F6N4O6/c1-2-3-13-39-19(36)14(31-18(35)16-9-6-12-33(16)21(38)23(27,28)29)7-4-10-30-17(34)15-8-5-11-32(15)20(37)22(24,25)26/h14-16H,2-13H2,1H3,(H,30,34)(H,31,35)/t14-,15-,16-/m0/s1 |
InChIKey | LLCWXAWXCBYJNC-JYJNAYRXSA-N |
Mol Weight | 574.5 g/mol |
Molecular Formula | C23H32F6N4O6 |
Exact Mass | 574.222604 g/mol |
SpectraBase Spectrum ID | I2H96NIRqpJ |
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Name | N,N'-Bis(tfa-L-prolyl)ornithine butyl ester |
CAS Registry Number | 63085-25-6 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C23H32F6N4O6 |
InChI | InChI=1S/C23H32F6N4O6/c1-2-3-13-39-19(36)14(31-18(35)16-9-6-12-33(16)21(38)23(27,28)29)7-4-10-30-17(34)15-8-5-11-32(15)20(37)22(24,25)26/h14-16H,2-13H2,1H3,(H,30,34)(H,31,35)/t14-,15-,16-/m0/s1 |
InChIKey | LLCWXAWXCBYJNC-JYJNAYRXSA-N |
Molecular Weight | 574.521 g/mol |
SMILES | N(C([C@]1(N(C(C(F)(F)F)=O)CCC1)[H])=O)[C@@](CCCNC([C@]1(N(C(C(F)(F)F)=O)CCC1)[H])=O)(C(=O)OCCCC)[H] |
SPLASH | splash10-01b9-5910000000-83732ebce0b0d06f136e |
Source of Spectrum | W5-1989-9632-1 |
Wiley ID | 1407985 |