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2-.beta.-Acetoxyverrucosane
SpectraBase Compound ID 5GQayOi7QWD
InChI InChI=1S/C22H36O2/c1-13(2)16-7-8-20(4)9-10-21(5)11-15-12-22(15,6)19(24-14(3)23)18(21)17(16)20/h13,15-19H,7-12H2,1-6H3/t15-,16-,17?,18-,19-,20+,21-,22+/m0/s1
InChIKey MYEVRSWUQGIDRP-DFTCEIPHSA-N
Mol Weight 332.5 g/mol
Molecular Formula C22H36O2
Exact Mass 332.27153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HRhoGIDjj9F
Name 2-.beta.-Acetoxyverrucosane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H36O2
InChI InChI=1S/C22H36O2/c1-13(2)16-7-8-20(4)9-10-21(5)11-15-12-22(15,6)19(24-14(3)23)18(21)17(16)20/h13,15-19H,7-12H2,1-6H3/t15-,16-,17?,18-,19-,20+,21-,22+/m0/s1
InChIKey MYEVRSWUQGIDRP-DFTCEIPHSA-N
Molecular Weight 332.528 g/mol
SMILES [C@@]12([C@](C[C@]3([C@]([C@@]2(OC(=O)C)[H])(C2[C@](CC[C@]2(C(C)C)[H])(CC3)C)[H])C)([H])C1)C
SPLASH splash10-0006-9480000000-d222a463aaa6b110f4dd
Source of Spectrum M-30-327-2
Synonyms (1S,3aR,5aS,6aS,7aR,8S,8aR)-1-isopropyl-3a,5a,7a-trimethyltetradecahydrocyclopenta[a]cyclopropa[g]naphthalen-8-yl acetate
Wiley ID 1329938