| SpectraBase Spectrum ID |
7xdIbHWxbQx |
| Name |
2-methylpentane-1,3-diol |
| Alternate Name(s) |
1,3-Pentanediol, 2-methyl-
2-Methyl-1,3-pentanediol
AI3-00937 |
| CAS Registry Number |
149-31-5 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C6H14O2 |
| InChI |
InChI=1S/C6H14O2/c1-3-6(8)5(2)4-7/h5-8H,3-4H2,1-2H3 |
| InChIKey |
SPXWGAHNKXLXAP-UHFFFAOYSA-N |
| Molecular Weight |
118.176 g/mol |
| SMILES |
OC(C(CO)C)CC |
| SPLASH |
splash10-0gb9-0900000000-dd00d0f9284cfb322c65 |
| Source of Spectrum |
J-52-5704-15 |
| Wiley ID |
1126578 |
