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.epsilon.-Methyl-.epsilon.-caprolactone

View entire compound with spectra: 1 NMR, and 5 MS (GC)

.epsilon.-Methyl-.epsilon.-caprolactone
SpectraBase Compound ID F8faWxs4dP0
InChI InChI=1S/C7H12O2/c1-6-4-2-3-5-7(8)9-6/h6H,2-5H2,1H3
InChIKey WZRNGGFHDMOCEA-UHFFFAOYSA-N
Mol Weight 128.17 g/mol
Molecular Formula C7H12O2
Exact Mass 128.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EqK99A7c6Wg
Name .epsilon.-Methyl-.epsilon.-caprolactone
CAS Registry Number 2549-59-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O2
InChI InChI=1S/C7H12O2/c1-6-4-2-3-5-7(8)9-6/h6H,2-5H2,1H3
InChIKey WZRNGGFHDMOCEA-UHFFFAOYSA-N
Molecular Weight 128.171 g/mol
SMILES CC1CCCCC(O1)=O
SPLASH splash10-0a4i-9000000000-e34c0d12a0048b1346ba
Synonyms 2-Oxepanone, 7-methyl- 7-Methyl-oxepan-2-one 7-Methyl-2-oxepanone 7-Methyloxepan-2-one 6-Methyl-epsilon-caprolactone
Wiley ID 1490379