SpectraBase Spectrum ID |
CZQx3r8M9ac |
Name |
(-)-bicyclogermacra-1(10)(E),4(E)-dien-3.beta.-ol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
220.182715392 u |
Formula |
C15H24O |
InChI |
InChI=1S/C15H24O/c1-10-5-7-12-13(15(12,3)4)9-11(2)14(16)8-6-10/h6,9,12-14,16H,5,7-8H2,1-4H3/b10-6+,11-9+/t12-,13-,14+/m1/s1 |
InChIKey |
AMZJPZQKYICVMX-FQLBQQKJSA-N |
Molecular Weight |
220.356 g/mol |
SMILES |
[C@]12(C(C)(C)[C@@]2(CC\C(=C\C[C@@](\C(=C\1)C)(O)[H])C)[H])[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.975834 |