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2-[3-Chloro-2-(propylsulfonyl)propyl]-1H-isoindole-1,3(2H)-dione
SpectraBase Compound ID ELXsrEHO12Q
InChI InChI=1S/C14H16ClNO4S/c1-2-7-21(19,20)10(8-15)9-16-13(17)11-5-3-4-6-12(11)14(16)18/h3-6,10H,2,7-9H2,1H3
InChIKey NYDUBDGNENSSGA-UHFFFAOYSA-N
Mol Weight 329.8 g/mol
Molecular Formula C14H16ClNO4S
Exact Mass 329.048857 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2hbdnDNjnPK
Name 2-[3-Chloro-2-(propylsulfonyl)propyl]-1H-isoindole-1,3(2H)-dione
CAS Registry Number 116623-62-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16ClNO4S
InChI InChI=1S/C14H16ClNO4S/c1-2-7-21(19,20)10(8-15)9-16-13(17)11-5-3-4-6-12(11)14(16)18/h3-6,10H,2,7-9H2,1H3
InChIKey NYDUBDGNENSSGA-UHFFFAOYSA-N
Molecular Weight 329.798 g/mol
SMILES c1cccc2c1C(N(C2=O)CC(CCl)S(=O)(CCC)=O)=O
SPLASH splash10-000i-6920000000-ef6efa04e9b7dfcdebd0
Source of Spectrum AD-0-2532-0
Synonyms 2-(3-Chloranyl-2-propylsulfonyl-propyl)isoindole-1,3-dione 2-(3-Chloro-2-propylsulfonyl-propyl)isoindoline-1,3-dione 2-(3-Chloro-2-propylsulfonyl-propyl)isoindoline-1,3-quinone 2-(3-Chloro-2-propylsulfonylpropyl)isoindole-1,3-dione Isoindole-1,3(2H)-dione, 2-[3-chloro-2-(propylsulfonyl)propyl]-
Wiley ID 1424621