SpectraBase Spectrum ID |
EQK1Vrl6cEe |
Name |
neo-Isopinocamphenyl phenyl ether |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
230.167065327 u |
Formula |
C16H22O |
InChI |
InChI=1S/C16H22O/c1-11-14-9-12(16(14,2)3)10-15(11)17-13-7-5-4-6-8-13/h4-8,11-12,14-15H,9-10H2,1-3H3/t11?,12-,14+,15?/m0/s1 |
InChIKey |
SUDXKFZTIMDWMM-HCWKNACYSA-N |
Molecular Weight |
230.351 g/mol |
SMILES |
[C@@]12(C(C)(C)[C@@](C2)(CC(C1C)OC1=CC=CC=C1)[H])[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.820506 |