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3-(2-Chloroethyl)-2,4(1H,3H)-quinazolinedione
SpectraBase Compound ID 5xyB3dfc4qd
InChI InChI=1S/C10H9ClN2O2/c11-5-6-13-9(14)7-3-1-2-4-8(7)12-10(13)15/h1-4H,5-6H2,(H,12,15)
InChIKey HWFSVCPXNLEACG-UHFFFAOYSA-N
Mol Weight 224.65 g/mol
Molecular Formula C10H9ClN2O2
Exact Mass 224.035255 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7qeGoRDEXog
Name 2,4(1H,3H)-Quinazolinedione, 3-(2-chloroethyl)-
CAS Registry Number 5081-87-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9ClN2O2
InChI InChI=1S/C10H9ClN2O2/c11-5-6-13-9(14)7-3-1-2-4-8(7)12-10(13)15/h1-4H,5-6H2,(H,12,15)
InChIKey HWFSVCPXNLEACG-UHFFFAOYSA-N
Molecular Weight 224.647 g/mol
SMILES N1C(N(C(c2c1cccc2)=O)CCCl)=O
SPLASH splash10-0295-5910000000-43bf4990b399c570f770
Source of Spectrum AD-0-2532-0
Synonyms 3-(2-Chloroethyl)(1H,3H)quinazoline-2,4-dione 3-(2-Chloroethyl)-1H-quinazoline-2,4-dione 3-(2-Chloroethyl)-1H-quinazoline-2,4-quinone 3-(2-Chloroethyl)-2,4(1H,3H)-quinazolinedione EINECS 225-795-3
Wiley ID 1433004