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4-(1H-Isochromen-3-yl)butan-2-one

View entire compound with spectra: 1 MS (GC)

4-(1H-Isochromen-3-yl)butan-2-one
SpectraBase Compound ID 2Z8XZL2UILs
InChI InChI=1S/C13H14O2/c1-10(14)6-7-13-8-11-4-2-3-5-12(11)9-15-13/h2-5,8H,6-7,9H2,1H3
InChIKey NYALOGMGLLZXGK-UHFFFAOYSA-N
Mol Weight 202.25 g/mol
Molecular Formula C13H14O2
Exact Mass 202.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ATTlkct29MP
Name 4-(1H-Isochromen-3-yl)butan-2-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O2
InChI InChI=1S/C13H14O2/c1-10(14)6-7-13-8-11-4-2-3-5-12(11)9-15-13/h2-5,8H,6-7,9H2,1H3
InChIKey NYALOGMGLLZXGK-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200600191
Molecular Weight 202.253 g/mol
SMILES CC(CCC=1OCc2ccccc2C1)=O
SPLASH splash10-0f6x-1920000000-5ab680b2ab889b2466e4
Source of Spectrum QA-53-1460-17a
Wiley ID 1796247