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Isochroman

View entire compound with spectra: 10 NMR, 6 FTIR, 1 Raman, and 4 MS (GC)

Isochroman
SpectraBase Compound ID EsCSxHAlwwo
InChI InChI=1S/C9H10O/c1-2-4-9-7-10-6-5-8(9)3-1/h1-4H,5-7H2
InChIKey HEBMCVBCEDMUOF-UHFFFAOYSA-N
Mol Weight 134.18 g/mol
Molecular Formula C9H10O
Exact Mass 134.073165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DkPUFetYY3H
Name Isochroman
Alternate Name(s) 1H-2-Benzopyran, 3,4-dihydro- 3,4-Dihydro-1H-2-benzopyran 3,4-Dihydro-1H-isochromene Isochromane
CAS Registry Number 493-05-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10O
InChI InChI=1S/C9H10O/c1-2-4-9-7-10-6-5-8(9)3-1/h1-4H,5-7H2
InChIKey HEBMCVBCEDMUOF-UHFFFAOYSA-N
Molecular Weight 134.178 g/mol
SMILES c12c(COCC2)cccc1
SPLASH splash10-0ue9-5900000000-3ea81e4f6a05d08c9c30
Wiley ID 1474422