For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3ah-cyclopenta(b)benzofuran-3a-methanol, 1,2,3,4a,7,8,8a,8b-octahydro-2-hydroxy-6,8a,8b-trimethyl-, (2R-(2alpha,3abeta,4abeta,8aalpha,8bbeta))-
SpectraBase Compound ID ElEI3paeA1o
InChI InChI=1S/C15H24O3/c1-10-4-5-13(2)12(6-10)18-15(9-16)8-11(17)7-14(13,15)3/h6,11-12,16-17H,4-5,7-9H2,1-3H3/t11-,12-,13-,14+,15-/m1/s1
InChIKey LRGJZQCUGTZKGE-ARILJUKYSA-N
Mol Weight 252.35 g/mol
Molecular Formula C15H24O3
Exact Mass 252.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID XoUCRNFbYn
Name 3ah-cyclopenta(b)benzofuran-3a-methanol, 1,2,3,4a,7,8,8a,8b-octahydro-2-hydroxy-6,8a,8b-trimethyl-, (2R-(2alpha,3abeta,4abeta,8aalpha,8bbeta))-
Alternate Name(s) 3alpha,13-dihydroxy-apotrichothec-9-ene Apotrichodiol
CAS Registry Number 104148-45-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O3
InChI InChI=1S/C15H24O3/c1-10-4-5-13(2)12(6-10)18-15(9-16)8-11(17)7-14(13,15)3/h6,11-12,16-17H,4-5,7-9H2,1-3H3/t11-,12-,13-,14+,15-/m1/s1
InChIKey LRGJZQCUGTZKGE-ARILJUKYSA-N
Molecular Weight 252.354 g/mol
SMILES O[C@@]1(C[C@@]2([C@@](CO)(O[C@@]3(C=C(CC[C@@]23C)C)[H])C1)C)[H]
SPLASH splash10-053r-6920000000-6cab777377048d326866
Source of Spectrum J-54-4317-8
Wiley ID 1255905