| SpectraBase Spectrum ID |
IxirN3Rbl4p |
| Name |
2,4-Pentanediol, 3-methyl- |
| Alternate Name(s) |
3-Methylpentane-2,4-diol
3-Methylpentanediol-2,4
EINECS 227-150-1 |
| CAS Registry Number |
5683-44-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C6H14O2 |
| InChI |
InChI=1S/C6H14O2/c1-4(5(2)7)6(3)8/h4-8H,1-3H3 |
| InChIKey |
RBQLGIKHSXQZTB-UHFFFAOYSA-N |
| Molecular Weight |
118.176 g/mol |
| SMILES |
OC(C(C(C)O)C)C |
| SPLASH |
splash10-0a4i-9000000000-f4bb691f9b6a0e5a0b11 |
| Source of Spectrum |
HE-1982-0-0 |
| Wiley ID |
1126498 |
