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rel-(1R,2S,3R,6S)-1,3-dimethyl-7-methylenespiro[bicyclo[4.2.0]octane-2,1'-cyclopentane]-3',5-dione 3'-ethylene acetal
SpectraBase Compound ID 9WstZSCv8v3
InChI InChI=1S/C17H24O3/c1-11-9-15(3)14(11)13(18)8-12(2)16(15)4-5-17(10-16)19-6-7-20-17/h12,14H,1,4-10H2,2-3H3/t12-,14-,15-,16+/m1/s1
InChIKey NIEFXVOCTBAFOM-MIGQKNRLSA-N
Mol Weight 276.38 g/mol
Molecular Formula C17H24O3
Exact Mass 276.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DrtBvBkG11r
Name rel-(1R,2S,3R,6S)-1,3-dimethyl-7-methylenespiro[bicyclo[4.2.0]octane-2,1'-cyclopentane]-3',5-dione 3'-ethylene acetal
CAS Registry Number 113353-05-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O3
InChI InChI=1S/C17H24O3/c1-11-9-15(3)14(11)13(18)8-12(2)16(15)4-5-17(10-16)19-6-7-20-17/h12,14H,1,4-10H2,2-3H3/t12-,14-,15-,16+/m1/s1
InChIKey NIEFXVOCTBAFOM-MIGQKNRLSA-N
Molecular Weight 276.376 g/mol
SMILES [C@]12([C@]3([C@](C)(CC([C@@]2([H])C(C1)=C)=O)[H])CC1(OCCO1)CC3)C
SPLASH splash10-0002-9000000000-bb8904b4cc9843271b4f
Source of Spectrum J-53-1625-9
Synonyms (1R,2S,3R,6S)-1,3-dimethyl-7-methylidenedispiro[bicyclo[4.2.0]octane-2,1'-cyclopentane-3',2''-[1,3]dioxolane]-5-one
Wiley ID 1280349