Debug Info

object
{15}
_id
:
Dmo45Yh9f8u
spectrumID
:
Dmo45Yh9f8u
cost
:
1
specType
:
131072
xnmrNucleus
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0
dbLocation
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WMSL3X:127184:1
hasStructureAssignments
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false
properties
{11}
analyticalTechnique
:
MS (GC)
analyticalTechniqueLongName
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Mass Spectrum (GC)
isFullSpectrum
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false
spectralOutlier
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false
compound
{10}
lastUpdated
:
1735074081058
isDeprecated
:
false

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(+)-cis-Cularidine-N-oxide
SpectraBase Compound ID 9cho8Qqfk1s
InChI InChI=1S/C19H21NO5/c1-20(22)7-6-11-4-5-14(21)19-18(11)13(20)8-12-9-16(23-2)17(24-3)10-15(12)25-19/h4-5,9-10,13,21H,6-8H2,1-3H3/t13-,20-/m0/s1
InChIKey QAPTXJJVIRGSFG-RBZFPXEDSA-N
Mol Weight 343.38 g/mol
Molecular Formula C19H21NO5
Exact Mass 343.141973 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dmo45Yh9f8u
Name (+)-cis-Cularidine-N-oxide
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21NO5
InChI InChI=1S/C19H21NO5/c1-20(22)7-6-11-4-5-14(21)19-18(11)13(20)8-12-9-16(23-2)17(24-3)10-15(12)25-19/h4-5,9-10,13,21H,6-8H2,1-3H3/t13-,20-/m0/s1
InChIKey QAPTXJJVIRGSFG-RBZFPXEDSA-N
Molecular Weight 343.379 g/mol
SMILES Oc1c2c3[C@@]([N@@+]([O-])(CCc3cc1)C)(Cc1c(cc(c(c1)OC)OC)O2)[H]
SPLASH splash10-03di-0019000000-2f8f2cd862c11e6ad1f9
Source of Spectrum H1-41-2583-2
Synonyms (1S,12aS)-9,10-dimethoxy-1-methyl-2,3,12,12a-tetrahydro-1H-[1]benzoxepino[2,3,4-ij]isoquinolin-6-ol 1-oxide
Wiley ID 757375
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