| SpectraBase Spectrum ID |
26OswqX3dA |
| Name |
3-Methylhexane |
| CAS Registry Number |
589-34-4 |
| Classification |
Solvent |
| Comments |
Original RI info: <1000* |
| Copyright |
Copyright © 2023-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
100.125200515 u |
| Formula |
C7H16 |
| InChI |
InChI=1S/C7H16/c1-4-6-7(3)5-2/h7H,4-6H2,1-3H3 |
| InChIKey |
VLJXXKKOSFGPHI-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
100.205 g/mol |
| SMILES |
CCC(CCC)C |
| SPLASH |
splash10-002f-9000000000-ea9789898d5cf709a53a |
| Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_3820 |
