SpectraBase Spectrum ID |
4oHKZASJrlp |
Name |
Dimethylphenethylcarbinol acetate |
CAS Registry Number |
103-07-1 |
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 |
206.130679818 u |
Formula |
C13H18O2 |
InChI |
InChI=1S/C13H18O2/c1-11(14)15-13(2,3)10-9-12-7-5-4-6-8-12/h4-8H,9-10H2,1-3H3 |
InChIKey |
ZXFNOEJFYLQUSB-UHFFFAOYSA-N |
Molecular Weight |
206.285 g/mol |
Number of Peaks |
50 |
RI1 |
1439 |
RI2 |
1118 |
SMILES |
c1(ccccc1)CCC(C)(OC(C)=O)C |
SPLASH |
splash10-001l-6900000000-78f1a60ec756d6401b5f |
Sample Comments |
RI1: measured on SLB-5ms (Hydro)
RI2: measured on SLB-5ms (FAMEs)
RI3: measured on Supelcowax-10 (FAMEs)
RI4: measured on Supelcowax-10 (FAEEs)
RI5: measured on Equity-1 (Hydro) |
Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
Synonyms |
Benzenepropanol, alpha,alpha-dimethyl-, acetate |
Wiley ID |
LM_FFNSC3_1235 |