| SpectraBase Compound ID | 1avx28GJsMy |
|---|---|
| InChI | InChI=1S/C25H32ClN5O7/c1-3-15-22(35)29-17(12-32)23(36)28-16(14-7-5-4-6-8-14)11-20(34)30-21(13(2)33)25(38)31-18(24(37)27-15)9-10-19(31)26/h4-8,10,13,15-18,21,32-33H,3,9,11-12H2,1-2H3,(H,27,37)(H,28,36)(H,29,35)(H,30,34)/t13?,15-,16+,17-,18-,21+/m0/s1 |
| InChIKey | MBBZPVISCABKRR-DTOBEXPWSA-N |
| Mol Weight | 550.0 g/mol |
| Molecular Formula | C25H32ClN5O7 |
| Exact Mass | 549.199026 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | Eg08sZ1Z8LA |
|---|---|
| Name | ASTIN-H |
| Compound Number | 3 |
| Copyright | Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C25H32ClN5O7/c1-3-15-22(35)29-17(12-32)23(36)28-16(14-7-5-4-6-8-14)11-20(34)30-21(13(2)33)25(38)31-18(24(37)27-15)9-10-19(31)26/h4-8,10,13,15-18,21,32-33H,3,9,11-12H2,1-2H3,(H,27,37)(H,28,36)(H,29,35)(H,30,34)/t13?,15-,16+,17-,18-,21+/m0/s1 |
| InChIKey | MBBZPVISCABKRR-DTOBEXPWSA-N |
| Literature Reference | H.MORITA,S.NAGASHIMA,K.TAKEYA,H.ITOKAWA HETEROCYCLES,38,2247(1994) |
| Solvent | Dimethyl sulfoxide-d6 |
| Technique | SELECTIVE DECOUPLING; C/H SHIFT CORRELATION |