CID 3049773

1,6-methano-1h-4-benzazonin-10-ol, 2,3,4,5,6,7-hexahydro-4-methyl-, hydrobromide

Structural Information

Molecular Formula
C14H19NO
SMILES
CN1CCC2CC(C1)CC3=C2C=C(C=C3)O
InChI
InChI=1S/C14H19NO/c1-15-5-4-12-7-10(9-15)6-11-2-3-13(16)8-14(11)12/h2-3,8,10,12,16H,4-7,9H2,1H3
InChIKey
HPNLYVACULLUHJ-UHFFFAOYSA-N
Compound name
11-methyl-11-azatricyclo[7.4.1.02,7]tetradeca-2(7),3,5-trien-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

217.14667 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.153946 146.6
[M+Na]+ 240.135888 152.4
[M-H]- 216.139394 148.9
[M+NH4]+ 235.180493 165.2
[M+K]+ 256.109828 151.7
[M+H-H2O]+ 200.143930 141.7
[M+HCOO]- 262.144871 160.6
[M+CH3COO]- 276.160521 157.4
[M+Na-2H]- 238.121336 152.7
[M]+ 217.14612142 140.6
[M]- 217.14721858 140.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe