This information is based on the molecular structure shown on the left side. For a decoupled sample, please refer to its individual details.

Formula: C16H22N2O3


Canonical SMILES:
COCCOc1ccc2c(c1)[nH]cc2CN1CCOCC1
InChI:
InChI=1S/C16H22N2O3/c1-19-8-9-21-14-2-3-15-13(11-17-16(15)10-14)12-18-4-6-20-7-5-18/h2-3,10-11,17H,4-9,12H2,1H3
InChIKey:
DTAVASNDFAQYBW-UHFFFAOYSA-N
Exact Mass:
Crosslinks:   


Published on 2023-07-31No License

 

mass spectrometry (MS) 
Author: Niklas Krappel1

1. IBCS-FMS, Karlsruhe Institute of Technology, Germany

Analysis DOI:
Analysis ID:
Content:   
MS (EI, 70 eV, 100 °C), m/z (%): 290 (29) [M]+, 204 (100) [M - morpholin]+, 146 (34) [M - morpholin - methoxy ethyl]+, 117 (10), 59 (17) [methoxy ethyl]+. HRMS–EI (C16H22O3N2) (m/z): [M]+ calcd 290.1625; found 290.1626.
Datasets