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1-(3-Benzylselanylpropyl)nonyl carbonochloridate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1-(3-Benzylselanylpropyl)nonyl carbonochloridate
SpectraBase Compound ID 9TGajxH5t4F
InChI InChI=1S/C20H31ClO2Se/c1-2-3-4-5-6-10-14-19(23-20(21)22)15-11-16-24-17-18-12-8-7-9-13-18/h7-9,12-13,19H,2-6,10-11,14-17H2,1H3
InChIKey ICWXZWVLRFZNCU-UHFFFAOYSA-N
Mol Weight 417.89 g/mol
Molecular Formula C20H31ClO2Se
Exact Mass 418.11778 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5vj4OBgrDr3
Name 1-(3-Benzylselanylpropyl)nonyl carbonochloridate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 418.117779936 u
Formula C20H31ClO2Se
InChI InChI=1S/C20H31ClO2Se/c1-2-3-4-5-6-10-14-19(23-20(21)22)15-11-16-24-17-18-12-8-7-9-13-18/h7-9,12-13,19H,2-6,10-11,14-17H2,1H3
InChIKey ICWXZWVLRFZNCU-UHFFFAOYSA-N
Molecular Weight 417.891 g/mol
SMILES C(=O)(OC(CCCCCCCC)CCC[Se]CC=1C=CC=CC1)Cl