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1(2H)-Naphthalenone, 3,4-dihydro-6-methoxy-2-[6-methyl-6-[2-(1-piperidinyl)ethenyl]-1,4-dioxaspiro[4.4]non-7-yl]-, [6R-[6.alpha.(E),7.beta.(S*)]]-
SpectraBase Compound ID Je85mgNDTbB
InChI InChI=1S/C26H35NO4/c1-25(12-15-27-13-4-3-5-14-27)23(10-11-26(25)30-16-17-31-26)22-8-6-19-18-20(29-2)7-9-21(19)24(22)28/h7,9,12,15,18,22-23H,3-6,8,10-11,13-14,16-17H2,1-2H3/b15-12+/t22?,23?,25-/m0/s1
InChIKey VUPIBLCYMFEYGZ-IZFHMQDISA-N
Mol Weight 425.6 g/mol
Molecular Formula C26H35NO4
Exact Mass 425.256609 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kjikrc1CkGX
Name 1(2H)-Naphthalenone, 3,4-dihydro-6-methoxy-2-[6-methyl-6-[2-(1-piperidinyl)ethenyl]-1,4-dioxaspiro[4.4]non-7-yl]-, [6R-[6.alpha.(E),7.beta.(S*)]]-
Alternate Name(s) 1,4-Dioxaspiro[4.4]nonane, 1(2H)-naphthalenone deriv. (E)-17,17-(ethylenedioxy)-3-methoxy-11-(1'-piperidinyl)-9,11-seco-1,3,5(10),11-estratetraen-9-one 6-Methoxy-2-{(6R)-6-methyl-6-[(E)-2-(1-piperidinyl)ethenyl]-1,4-dioxaspiro[4.4]non-7-yl}-3,4-dihydro-1(2H)-naphthalenone
CAS Registry Number 125285-35-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H35NO4
InChI InChI=1S/C26H35NO4/c1-25(12-15-27-13-4-3-5-14-27)23(10-11-26(25)30-16-17-31-26)22-8-6-19-18-20(29-2)7-9-21(19)24(22)28/h7,9,12,15,18,22-23H,3-6,8,10-11,13-14,16-17H2,1-2H3/b15-12+/t22?,23?,25-/m0/s1
InChIKey VUPIBLCYMFEYGZ-IZFHMQDISA-N
Molecular Weight 425.569 g/mol
SMILES [C@@]1(C2(OCCO2)CCC1C1C(c2ccc(cc2CC1)OC)=O)(\C=C\N1CCCCC1)C
SPLASH splash10-0f9i-1900000000-60d4b31dff23b20529b6
Source of Spectrum H-72-728-8
Wiley ID 1379690