| SpectraBase Spectrum ID |
Bi8Ok9nNTWH |
| Name |
.beta.-Amyrin |
| CAS Registry Number |
559-70-6 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
426.386166229 u |
| Formula |
C30H50O |
| GC Column |
HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness) |
| InChI |
InChI=1S/C30H50O/c1-25(2)15-16-27(5)17-18-29(7)20(21(27)19-25)9-10-23-28(6)13-12-24(31)26(3,4)22(28)11-14-30(23,29)8/h9,21-24,31H,10-19H2,1-8H3/t21-,22-,23+,24-,27+,28-,29+,30+/m0/s1 |
| InChIKey |
JFSHUTJDVKUMTJ-QHPUVITPSA-N |
| Molecular Weight |
426.729 g/mol |
| Nominal Mass |
426 u |
| Number of Peaks |
128 |
| SMILES |
O[C@@]1(C([C@]2([C@@]([C@@]3([C@]([C@]4(C([C@]5([C@@](CC4)(CCC(C5)(C)C)C)[H])=CC3)C)(CC2)C)[H])(CC1)C)[H])(C)C)[H] |
| SPLASH |
splash10-014i-3970000000-42bf0534a3b1adc1d680 |
| Source |
Forsythia flowers |
| Source of Spectrum |
Biologically and Environmentally Important Organic Compounds: GCMS Library |
| Wiley ID |
VI000969 |
