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ELMOCLAVINE
SpectraBase Compound ID K3EFEXMA4sb
InChI InChI=1S/C16H18N2O/c1-18-8-10(9-19)5-13-12-3-2-4-14-16(12)11(7-17-14)6-15(13)18/h2-5,7,13,15,17,19H,6,8-9H2,1H3
InChIKey DAVNRFCJMIONPO-UHFFFAOYSA-N
Mol Weight 254.33 g/mol
Molecular Formula C16H18N2O
Exact Mass 254.141913 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H4q8qStqoO
Name Ergoline-8-methanol, 8,9-didehydro-6-methyl-
CAS Registry Number 548-43-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18N2O
InChI InChI=1S/C16H18N2O/c1-18-8-10(9-19)5-13-12-3-2-4-14-16(12)11(7-17-14)6-15(13)18/h2-5,7,13,15,17,19H,6,8-9H2,1H3
InChIKey DAVNRFCJMIONPO-UHFFFAOYSA-N
Molecular Weight 254.333 g/mol
SMILES OCC1=CC2C(N(C)C1)Cc1c[nH]c3c1c2ccc3
SPLASH splash10-0ue9-0890000000-e6610e02066ec1f67436
Source of Spectrum KO-9-165-2
Synonyms (6-Methyl-8,9-didehydroergolin-8-yl)methanol 8,9-Didehydro-6-methylergoline-8-methanol Dihydrolysergol Elimoclavin Elymoclavin Elymoclavine Indolo[4,3-fg]quinoline, ergoline-8-methanol deriv. BRN 0030650 EINECS 208-948-9 NSC 109431
Wiley ID 1258109