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N-desethyl Isotonitazene
SpectraBase Compound ID DcvQtYBVrAm
InChI InChI=1S/C21H26N4O3/c1-4-22-11-12-24-20-10-7-17(25(26)27)14-19(20)23-21(24)13-16-5-8-18(9-6-16)28-15(2)3/h5-10,14-15,22H,4,11-13H2,1-3H3
InChIKey HHBRZWRJZICFRP-UHFFFAOYSA-N
Mol Weight 382.46 g/mol
Molecular Formula C21H26N4O3
Exact Mass 382.200491 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 598ktFCBAp1
Name N-desethyl Isotonitazene
Catalog Number 30216
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26N4O3
InChI InChI=1S/C21H26N4O3/c1-4-22-11-12-24-20-10-7-17(25(26)27)14-19(20)23-21(24)13-16-5-8-18(9-6-16)28-15(2)3/h5-10,14-15,22H,4,11-13H2,1-3H3
InChIKey HHBRZWRJZICFRP-UHFFFAOYSA-N
Molecular Weight 382.464 g/mol
SMILES N(CC)CC[n]1c(Cc2ccc(OC(C)C)cc2)nc2cc([N+]([O-])=O)ccc12
SPLASH splash10-0a6s-2965000000-c868d146f8149ce3d8a6
Source of Spectrum CAY-2023-254-0
Wiley ID 1888220