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Spiro[7H-benz[e]indene-7,2'-[1,3]dioxolan]-3-ol, 6-(2-butenyl)dodecahydro-3a,6-dimethyl-, acetate, [3S-[3.alpha.,3a.alpha.,5a.beta.,6.beta.(Z),9a.alpha.,9b.beta.]]-
SpectraBase Compound ID 32GvccyOr80
InChI InChI=1S/C23H36O4/c1-5-6-11-22(4)19-10-12-21(3)18(7-8-20(21)27-16(2)24)17(19)9-13-23(22)25-14-15-26-23/h5-6,17-20H,7-15H2,1-4H3/b6-5-/t17?,18?,19?,20-,21-,22+/m0/s1
InChIKey BPVDTQBNXOUPCV-UNFJFYNPSA-N
Mol Weight 376.5 g/mol
Molecular Formula C23H36O4
Exact Mass 376.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KTdjytDH31j
Name Spiro[7H-benz[e]indene-7,2'-[1,3]dioxolan]-3-ol, 6-(2-butenyl)dodecahydro-3a,6-dimethyl-, acetate, [3S-[3.alpha.,3a.alpha.,5a.beta.,6.beta.(Z),9a.alpha.,9b.beta.]]-
Alternate Name(s) (5'S,6'S,10'R)-10'-[(2Z)-but-2-en-1-yl]-6',10'-dimethylspiro[1,3-dioxolane-2,11'-tricyclo[7.4.0.0(2,6)]tridecane]-5'-yl acetate (Z)-5,5-Ethylenedioxy-4,5-secoandrost-2-en-17.beta.-yl acetate
CAS Registry Number 81917-19-3
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H36O4
InChI InChI=1S/C23H36O4/c1-5-6-11-22(4)19-10-12-21(3)18(7-8-20(21)27-16(2)24)17(19)9-13-23(22)25-14-15-26-23/h5-6,17-20H,7-15H2,1-4H3/b6-5-/t17?,18?,19?,20-,21-,22+/m0/s1
InChIKey BPVDTQBNXOUPCV-UNFJFYNPSA-N
Molecular Weight 376.537 g/mol
SMILES [C@@]12(C(C3CCC4([C@@](C3CC2)(C\C=C/C)C)OCCO4)CC[C@@]1(OC(=O)C)[H])C
SPLASH splash10-0002-9000000000-5eb2a580c97513013e36
Source of Spectrum KC-1982-515-0
Wiley ID 1357963