| SpectraBase Spectrum ID |
2Qra9N1WmO |
| Name |
Cholesterol <25-hydroxy-> |
| CAS Registry Number |
2140-46-7 |
| 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 |
402.349780719 u |
| Formula |
C27H46O2 |
| GC Column |
HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness) |
| InChI |
InChI=1S/C27H46O2/c1-18(7-6-14-25(2,3)29)22-10-11-23-21-9-8-19-17-20(28)12-15-26(19,4)24(21)13-16-27(22,23)5/h8,18,20-24,28-29H,6-7,9-17H2,1-5H3/t18?,20-,21-,22+,23-,24-,26-,27+/m0/s1 |
| InChIKey |
INBGSXNNRGWLJU-RUYHLHGNSA-N |
| Molecular Weight |
402.663 g/mol |
| Nominal Mass |
402 u |
| Number of Peaks |
416 |
| SMILES |
O[C@@]1(CC=2[C@@]([C@@]3([C@]([C@]4([C@@]([C@@](C(CCCC(O)(C)C)C)(CC4)[H])(CC3)C)[H])(CC2)[H])[H])(CC1)C)[H] |
| SPLASH |
splash10-0a4j-5932000000-4e2df5631e8e848eb516 |
| Source |
authentic preparation, Cayman |
| Source of Spectrum |
Biologically and Environmentally Important Organic Compounds: GCMS Library |
| Synonyms |
25-Hydroxycholesterol |
| Wiley ID |
VI001789 |
