| SpectraBase Compound ID | 1CTF8c0YfDo |
|---|---|
| InChI | InChI=1S/C14H25N3O9.ClH/c1-3-5(17-12(16)13(23)24)2-4(15)14(25-3)26-11-9(21)7(19)6(18)8(20)10(11)22;/h3-11,14,18-22H,2,15H2,1H3,(H2,16,17)(H,23,24);1H/t3?,4?,5?,6-,7-,8+,9-,10-,11+,14?;/m1./s1 |
| InChIKey | ZDRBJJNXJOSCLR-ROQHTSPSSA-N |
| Mol Weight | 415.83 g/mol |
| Molecular Formula | C14H26ClN3O9 |
| Exact Mass | 415.135757 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GnX2e8iwhBx |
|---|---|
| Name | D-CHIRO-INOSITOL, 3-O-[2-AMINO-4-(CARBOXYIMINOMETHYL)AMINO-2,3,4,6-T |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C14H26ClN3O9 |
| InChI | InChI=1S/C14H25N3O9.ClH/c1-3-5(17-12(16)13(23)24)2-4(15)14(25-3)26-11-9(21)7(19)6(18)8(20)10(11)22;/h3-11,14,18-22H,2,15H2,1H3,(H2,16,17)(H,23,24);1H/t3?,4?,5?,6-,7-,8+,9-,10-,11+,14?;/m1./s1 |
| InChIKey | ZDRBJJNXJOSCLR-ROQHTSPSSA-N |
| Instrument Name | XL-100 |
| Solvent | D2O |