For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-Azetidinone, 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-chlorophenoxy)-4-(2-thienyl)-
SpectraBase Compound ID Dr4iAVASBFq
InChI InChI=1S/C21H16ClNO4S/c22-14-4-6-15(7-5-14)27-20-19(18-2-1-9-28-18)23(21(20)24)11-13-3-8-16-17(10-13)26-12-25-16/h1-10,19-20H,11-12H2
InChIKey NSQOITFIJWAZQN-UHFFFAOYSA-N
Mol Weight 413.88 g/mol
Molecular Formula C21H16ClNO4S
Exact Mass 413.048857 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID CFZB7yd8kCp
Name 2-Azetidinone, 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-chlorophenoxy)-4-(2-thienyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H16ClNO4S
InChI InChI=1S/C21H16ClNO4S/c22-14-4-6-15(7-5-14)27-20-19(18-2-1-9-28-18)23(21(20)24)11-13-3-8-16-17(10-13)26-12-25-16/h1-10,19-20H,11-12H2
InChIKey NSQOITFIJWAZQN-UHFFFAOYSA-N
Molecular Weight 413.875 g/mol
SMILES c1ccc(C2C(C(N2Cc2ccc3c(c2)OCO3)=O)Oc2ccc(cc2)Cl)s1
SPLASH splash10-000i-4940000000-5fc0d3c60f0ff581906d
Source of Spectrum IY-1-4526-2
Synonyms 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-chlorophenoxy)-4-thiophen-2-yl-2-azetidinone 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-chlorophenoxy)-4-thiophen-2-ylazetidin-2-one 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-chlorophenoxy)-4-(2-thienyl)azetidin-2-one 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-chloranylphenoxy)-4-thiophen-2-yl-azetidin-2-one
Wiley ID 1653245