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3-Methoxy-1,2-didehydrocrinan
SpectraBase Compound ID 2CVp9qcEArc
InChI InChI=1S/C17H19NO3/c1-19-12-2-3-17-4-5-18(16(17)7-12)9-11-6-14-15(8-13(11)17)21-10-20-14/h2-3,6,8,12,16H,4-5,7,9-10H2,1H3
InChIKey HATSAIPBKRRCME-UHFFFAOYSA-N
Mol Weight 285.34 g/mol
Molecular Formula C17H19NO3
Exact Mass 285.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Vxe67TVJgR
Name 3-Methoxy-1,2-didehydrocrinan
CAS Registry Number 6835-79-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19NO3
InChI InChI=1S/C17H19NO3/c1-19-12-2-3-17-4-5-18(16(17)7-12)9-11-6-14-15(8-13(11)17)21-10-20-14/h2-3,6,8,12,16H,4-5,7,9-10H2,1H3
InChIKey HATSAIPBKRRCME-UHFFFAOYSA-N
Molecular Weight 285.343 g/mol
SMILES COC1CC2C3(c4c(cc5OCOc5c4)CN2CC3)C=C1
SPLASH splash10-014r-0490000000-bc9cb5993b6aa975c5fe
Source of Spectrum LQ-1992-2896-0
Synonyms Crinan, 1,2-didehydro-3-methoxy-, (3.alpha.)- 3H,6H-5,11b-Ethano[1,3]dioxolo[4,5-j]phenanthridine, crinan deriv. Buphanisin Buphanisine Crinan, 1,2-didehydro-3.alpha.-methoxy- BUPHANISIN B678018K241
Wiley ID 1289042