| SpectraBase Compound ID | AlRnxgQAGWL |
|---|---|
| InChI | InChI=1S/C30H46O2/c1-19(2)20-10-15-30(18-31)17-16-28(6)21(25(20)30)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h18,20-23,25H,1,8-17H2,2-7H3/t20-,21+,22-,23+,25+,27?,28?,29?,30+/m0/s1 |
| InChIKey | MHAVMNJPXLZEIG-YRRUJGQCSA-N |
| Mol Weight | 438.7 g/mol |
| Molecular Formula | C30H46O2 |
| Exact Mass | 438.349781 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5wjm3ufHTTB |
|---|---|
| Name | BETULONIC-ALDEHYDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O2 |
| InChI | InChI=1S/C30H46O2/c1-19(2)20-10-15-30(18-31)17-16-28(6)21(25(20)30)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h18,20-23,25H,1,8-17H2,2-7H3/t20-,21+,22-,23+,25+,27?,28?,29?,30+/m0/s1 |
| InChIKey | MHAVMNJPXLZEIG-YRRUJGQCSA-N |
| Literature Reference Author | N.MELNIKOVA,I.BURLOVA,T.KISELEVA,I.KLABUKOVA,M.GULENOVA,A.KI SLITSIN,V.VASIN,B.TA |
| Literature Reference Citation | MOLECULES,17,11849(2012) |
| Literature Reference DOI | 10.3390/molecules171011849 |
| Molecular Weight | 438.694 g/mol |
| Sample ID | 1425 |
| Solvent | DMSO-D6 |