SpectraBase Spectrum ID |
7Bf3175EfHM |
Name |
Cryptomeridiol |
CAS Registry Number |
4666-84-6 |
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 |
240.208930140 u |
Formula |
C15H28O2 |
GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness) |
GC Oven Program |
60 °C to 246 °C at 3 °C/min. |
InChI |
InChI=1S/C15H28O2/c1-13(2,16)11-6-9-14(3)7-5-8-15(4,17)12(14)10-11/h11-12,16-17H,5-10H2,1-4H3/t11-,12-,14-,15-/m1/s1 |
InChIKey |
LKKDASYGWYYFIK-QHSBEEBCSA-N |
Molecular Weight |
240.387 g/mol |
Nominal Mass |
240 u |
Number of Peaks |
139 |
SMILES |
O[C@@]1(CCC[C@]2([C@]1(C[C@](C(O)(C)C)(CC2)[H])[H])C)C |
SPLASH |
splash10-0a4m-9700000000-b9518af0cb613d5b0a27 |
Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
Wiley ID |
RA001501 |