SpectraBase Spectrum ID |
5GdRPMfBu37 |
Name |
Betulinol |
CAS Registry Number |
473-98-3 |
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 |
442.381080848 u |
Formula |
C30H50O2 |
GC Column |
HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness) |
InChI |
InChI=1S/C30H50O2/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/h20-25,31-32H,1,8-18H2,2-7H3 |
InChIKey |
FVWJYYTZTCVBKE-UHFFFAOYSA-N |
Molecular Weight |
442.728 g/mol |
Nominal Mass |
442 u |
Number of Peaks |
136 |
SMILES |
OC1C(C2C(C3C(C4(C(C5C(CO)(CC4)CCC5C(C)=C)CC3)C)(CC2)C)(CC1)C)(C)C |
SPLASH |
splash10-053m-6910000000-7adf77b77f09cc69cf5a |
Source |
Sigma-Aldrich |
Source of Spectrum |
Biologically and Environmentally Important Organic Compounds: GCMS Library |
Synonyms |
Lup-20(30)-ene-3,28-diol |
Wiley ID |
VI000313 |