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6-(Propyl-1,1-d2)dibenzo(d,f)(1,3)dioxepine
SpectraBase Compound ID JL6f5Oi27bv
InChI InChI=1S/C16H16O2/c1-2-7-16-17-14-10-5-3-8-12(14)13-9-4-6-11-15(13)18-16/h3-6,8-11,16H,2,7H2,1H3/i7D2
InChIKey LYYNMMFXYATWPX-RJSZUWSASA-N
Mol Weight 242.31 g/mol
Molecular Formula C16H14D2O2
Exact Mass 242.127583 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CmzjFYqCkUv
Name 6-(Propyl-1,1-d2)dibenzo(d,f)(1,3)dioxepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14D2O2
InChI InChI=1S/C16H16O2/c1-2-7-16-17-14-10-5-3-8-12(14)13-9-4-6-11-15(13)18-16/h3-6,8-11,16H,2,7H2,1H3/i7D2
InChIKey LYYNMMFXYATWPX-RJSZUWSASA-N
Literature Reference DOI 10.1002/rcm.2974
Molecular Weight 242.314 g/mol
SMILES c1-2c(OC(Oc3c2cccc3)C(CC)([D])[D])cccc1
SPLASH splash10-0006-1940000000-be2ed7adf6d1938b0694
Source of Spectrum RCM-21-1418-3a
Synonyms 6-(propyl-1,1-d2)dibenzo[d,f][1,3]dioxepine
Wiley ID 1814429