Laudanosine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML00100
Dataset description:
This MassBank record with Accession MSBNK-Washington_State_Univ-BML00100 contains the MS2 mass spectrum of Laudanosine with the InChIkey KGPAYJZAMGEDIQ-UHFFFAOYSA-N.
Source: Laudanosine
Chemical Info
InChI | InChI=1S/C21H27NO4/c1-22-9-8-15-12-20(25-4)21(26-5)13-16(15)17(22)10-14-6-7-18(23-2)19(11-14)24-3/h6-7,11-13,17H,8-10H2,1-5H3 |
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SMILES | CN1CCC2=CC(=C(C=C2C1CC3=CC(=C(C=C3)OC)OC)OC)OC |
InChI Key | KGPAYJZAMGEDIQ-UHFFFAOYSA-N |
Molecular Formula | C21H27NO4 |
Exact Mass | 357.194 g/mol |
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Additional Information
Field | Value |
---|---|
Data last updated | January 11, 2024 |
Metadata last updated | January 11, 2024 |
Created | January 11, 2024 |
Format | HTML |
License | Attribution-ShareAlike 4.0 International (CC BY-SA 4.0) |
Id | 7142e3c5-36ec-48ea-b7d5-8710cca6dcaf |
Package id | msbnk-washington_state_univ-bml00100 |
Resource type | HTML |
State | active |