SpectraBase Spectrum ID |
EXArOeZshuj |
Name |
Methyl butyl isovalerate<2-> |
CAS Registry Number |
2445-77-4 |
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 |
172.146329882 u |
Formula |
C10H20O2 |
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/C10H20O2/c1-5-9(4)7-12-10(11)6-8(2)3/h8-9H,5-7H2,1-4H3 |
InChIKey |
CYGPPWVXOWCHJB-UHFFFAOYSA-N |
Molecular Weight |
172.268 g/mol |
Nominal Mass |
172 u |
Number of Peaks |
65 |
SMILES |
C(OCC(CC)C)(CC(C)C)=O |
SPLASH |
splash10-059f-9000000000-5b9fd23ee7d56e8f2427 |
Source |
ex ALDRICH |
Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
Wiley ID |
RA001871 |