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2,4-Cycloheptadiene-1-propanal, 7-methoxy-
SpectraBase Compound ID K2CPKbhZkUN
InChI InChI=1S/C11H16O2/c1-13-11-8-4-2-3-6-10(11)7-5-9-12/h2-4,6,9-11H,5,7-8H2,1H3
InChIKey AEDVMCLVZYGFOV-UHFFFAOYSA-N
Mol Weight 180.25 g/mol
Molecular Formula C11H16O2
Exact Mass 180.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F1opZSsng4I
Name 2,4-Cycloheptadiene-1-propanal, 7-methoxy-
Alternate Name(s) 1-Methoxy-2-(3-(1-oxopropyl)-3,5-cycloheptadiene 3-(7-Methoxy-2,4-cycloheptadien-1-yl)propanal
CAS Registry Number 93111-83-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O2
InChI InChI=1S/C11H16O2/c1-13-11-8-4-2-3-6-10(11)7-5-9-12/h2-4,6,9-11H,5,7-8H2,1H3
InChIKey AEDVMCLVZYGFOV-UHFFFAOYSA-N
Molecular Weight 180.247 g/mol
SMILES C=1C=CCC(C(C1)CCC=O)OC
SPLASH splash10-0f96-9800000000-b69c206e153250250f0d
Source of Spectrum C-106-8222-0
Wiley ID 1176452