| SpectraBase Spectrum ID |
Bqy9fnPSi1Z |
| Name |
Benzalkonium chloride-1 -C7H8Cl |
| Classification |
Antiseptic |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
213.245650002 u |
| Formula |
C14H31N |
| InChI |
InChI=1S/C14H31N/c1-4-5-6-7-8-9-10-11-12-13-14-15(2)3/h4-14H2,1-3H3 |
| InChIKey |
YWFWDNVOPHGWMX-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
213.409 g/mol |
| Related CAS Registry Number(s) |
8001-54-5 |
| SMILES |
CN(C)CCCCCCCCCCCC |
| SPLASH |
splash10-0a4i-9000000000-4f32edc209a1853510c2 |
| 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. |
| Sample Preparation Procedure |
Detected: G P U |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Synonyms |
Benzalkonium chloride compound-1 -C7H8Cl |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_1057 |
