| SpectraBase Compound ID | 8SyqMre6zoB |
|---|---|
| InChI | InChI=1S/C26H45NO21/c1-6(32)27-11-21(47-25-18(39)15(36)12(33)7(2-28)44-25)13(34)8(3-29)43-24(11)48-22-14(35)9(4-30)45-26(19(22)40)46-20-10(5-31)42-23(41)17(38)16(20)37/h7-26,28-31,33-41H,2-5H2,1H3,(H,27,32)/t7?,8?,9?,10-,11?,12?,13?,14?,15?,16?,17-,18?,19?,20+,21?,22?,23+,24?,25?,26?/m1/s1 |
| InChIKey | AXQLFFDZXPOFPO-XVJRVUOFSA-N |
| Mol Weight | 707.6 g/mol |
| Molecular Formula | C26H45NO21 |
| Exact Mass | 707.248407 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L8nIzRJY260 |
|---|---|
| Name | Lacto-N-tetrose |
| CAS Registry Number | 14116-68-8 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C26H45NO21 |
| InChI | InChI=1S/C26H45NO21/c1-6(32)27-11-21(47-25-18(39)15(36)12(33)7(2-28)44-25)13(34)8(3-29)43-24(11)48-22-14(35)9(4-30)45-26(19(22)40)46-20-10(5-31)42-23(41)17(38)16(20)37/h7-26,28-31,33-41H,2-5H2,1H3,(H,27,32)/t7?,8?,9?,10-,11?,12?,13?,14?,15?,16?,17-,18?,19?,20+,21?,22?,23+,24?,25?,26?/m1/s1 |
| InChIKey | AXQLFFDZXPOFPO-XVJRVUOFSA-N |
| Instrument Name | Finnigan 4021 |
| Literature Reference | S. Sabesan, J.C. Paulson, J. Am. Chem. Soc. 108, 2068 (1986). |
| NMR Standard | Dioxane |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | D2O |