| SpectraBase Spectrum ID |
H5aXYp49aID |
| Name |
Hexanoic acid, 2-methyl- |
| CAS Registry Number |
4536-23-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C7H14O2 |
| InChI |
InChI=1S/C7H14O2/c1-3-4-5-6(2)7(8)9/h6H,3-5H2,1-2H3,(H,8,9) |
| InChIKey |
CVKMFSAVYPAZTQ-UHFFFAOYSA-N |
| Molecular Weight |
130.187 g/mol |
| SMILES |
OC(C(CCCC)C)=O |
| SPLASH |
splash10-05g3-9000000000-23e21ea3301059c95767 |
| Source of Spectrum |
UT-1990-1035-0 |
| Synonyms |
.alpha.-Methylcaproic acid
2-Hexanecarboxylic acid
2-Methyl-hexanoic acid
2-Methylcaproic acid
Methylhexanoic acid
BRN 1721227
EINECS 224-883-9
FEMA NO. 3191 |
| Wiley ID |
1132646 |
