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(1R,3aR,7aR)-1-[(E)-but-2-en-2-yl]-3,3,6-trimethyl-3a,4,5,7a-tetrahydro-1H-2-benzofuran
SpectraBase Compound ID Af923UXYglV
InChI InChI=1S/C15H24O/c1-6-11(3)14-12-9-10(2)7-8-13(12)15(4,5)16-14/h6,9,12-14H,7-8H2,1-5H3/b11-6+/t12-,13-,14+/m1/s1
InChIKey VPOHDSFXXYSOAH-HBFFOZPESA-N
Mol Weight 220.36 g/mol
Molecular Formula C15H24O
Exact Mass 220.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2MA33nCVhHz
Name (1R,3aR,7aR)-1-[(E)-but-2-en-2-yl]-3,3,6-trimethyl-3a,4,5,7a-tetrahydro-1H-2-benzofuran
CAS Registry Number 107602-63-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O
InChI InChI=1S/C15H24O/c1-6-11(3)14-12-9-10(2)7-8-13(12)15(4,5)16-14/h6,9,12-14H,7-8H2,1-5H3/b11-6+/t12-,13-,14+/m1/s1
InChIKey VPOHDSFXXYSOAH-HBFFOZPESA-N
Molecular Weight 220.356 g/mol
SMILES [C@@]1(OC([C@@]2(CCC(=C[C@@]12[H])C)[H])(C)C)(\C(=C\C)C)[H]
SPLASH splash10-00du-4900000000-512571f36db978ee1b9a
Source of Spectrum H-69-2034-11
Synonyms (1R,3aR,7aR)-1-[(E)-but-2-en-2-yl]-3,3,6-trimethyl-3a,4,5,7a-tetrahydro-1H-isobenzofuran (1R,3aR,7aR)-3,3,6-trimethyl-1-[(E)-1-methylprop-1-enyl]-3a,4,5,7a-tetrahydro-1H-isobenzofuran
Wiley ID 1220753