CID 11051917

N-methylpseudoconhydrine

Structural Information

Molecular Formula
C9H19NO
SMILES
CCC[C@H]1CC[C@@H](CN1C)O
InChI
InChI=1S/C9H19NO/c1-3-4-8-5-6-9(11)7-10(8)2/h8-9,11H,3-7H2,1-2H3/t8-,9-/m0/s1
InChIKey
MSYUGRASNIEUCW-IUCAKERBSA-N
Compound name
(3S,6S)-1-methyl-6-propylpiperidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.14667 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.153946 137.4
[M+Na]+ 180.135888 143.2
[M-H]- 156.139394 137.7
[M+NH4]+ 175.180493 156.8
[M+K]+ 196.109828 141.6
[M+H-H2O]+ 140.143930 131.6
[M+HCOO]- 202.144871 155.0
[M+CH3COO]- 216.160521 176.7
[M+Na-2H]- 178.121336 140.7
[M]+ 157.14612142 133.9
[M]- 157.14721858 133.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.