| SpectraBase Spectrum ID |
3ndoASwj0df |
| Name |
Hexane, 1-isothiocyanato- |
| CAS Registry Number |
4404-45-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C7H13NS |
| InChI |
InChI=1S/C7H13NS/c1-2-3-4-5-6-8-7-9/h2-6H2,1H3 |
| InChIKey |
WXYAXKKXIGHXDS-UHFFFAOYSA-N |
| Molecular Weight |
143.248 g/mol |
| SMILES |
CCCCCCN=C=S |
| SPLASH |
splash10-0006-9300000000-675839230491e3fdb95c |
| Source of Spectrum |
EK-1999-672-0 |
| Synonyms |
1-Isothiocyanatohexane
1-Hexyl isothiocyanate
Hexyl isothiocyanate
Isothiocyanic acid, hexyl ester
n-Hexyl isothiocyanate
CCRIS 7549
EINECS 224-549-2 |
| Wiley ID |
1141909 |
