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ent-19-chloro-17-norkauran-16-one

View entire compound with spectra: 1 MS (GC)

ent-19-chloro-17-norkauran-16-one
SpectraBase Compound ID CO7T734F1hi
InChI InChI=1S/C19H29ClO/c1-17(12-20)7-3-8-18(2)15(17)6-9-19-10-13(14(21)11-19)4-5-16(18)19/h13,15-16H,3-12H2,1-2H3/t13-,15-,16?,17+,18-,19+/m1/s1
InChIKey HKIJODSITSDIIW-QLQCSIMLSA-N
Mol Weight 308.89 g/mol
Molecular Formula C19H29ClO
Exact Mass 308.190693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CjFsaRosEPY
Name ent-19-chloro-17-norkauran-16-one
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 308.190693253 u
Formula C19H29ClO
InChI InChI=1S/C19H29ClO/c1-17(12-20)7-3-8-18(2)15(17)6-9-19-10-13(14(21)11-19)4-5-16(18)19/h13,15-16H,3-12H2,1-2H3/t13-,15-,16?,17+,18-,19+/m1/s1
InChIKey HKIJODSITSDIIW-QLQCSIMLSA-N
Instrument Name VG Autospec
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0002.806
Molecular Weight 308.893 g/mol
Quality 288
SMILES C1C[C@@]2([C@@]([C@](C1)(C)CCl)(CC[C@@]13C2CC[C@](C3)(C(C1)=O)[H])[H])C
SPLASH splash10-0a4i-5981000000-62ded58b3d21895b73e7
Source of Spectrum ARK-2001-52-52-2 (DOI: 10.3998/ark.5550190.0002.806)
Wiley ID 1908870