| SpectraBase Spectrum ID |
DxyeyB1N1CQ |
| Name |
Benzene, heptyl- |
| CAS Registry Number |
1078-71-3 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H20 |
| InChI |
InChI=1S/C13H20/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h6,8-9,11-12H,2-5,7,10H2,1H3 |
| InChIKey |
LBNXAWYDQUGHGX-UHFFFAOYSA-N |
| Molecular Weight |
176.303 g/mol |
| SMILES |
CCCCCCCc1ccccc1 |
| SPLASH |
splash10-0006-9200000000-138a36e31517d5020800 |
| Source of Spectrum |
J-58-2413-0 |
| Synonyms |
1-Phenylheptane
Heptane, 1(or 7)-phenyl-
Heptane, 1-phenyl-
Heptyl-benzene
n-Heptylbenzene
EINECS 214-084-3
NSC 97413 |
| Wiley ID |
1172849 |
