CID 108275

54915-22-9

Structural Information

Molecular Formula
C14H19NO
SMILES
C1CC2CN(CC1C3=CC=CC=C23)CCO
InChI
InChI=1S/C14H19NO/c16-8-7-15-9-11-5-6-12(10-15)14-4-2-1-3-13(11)14/h1-4,11-12,16H,5-10H2
InChIKey
JQGUDWWYARQUSU-UHFFFAOYSA-N
Compound name
2-(10-azatricyclo[6.3.2.02,7]trideca-2,4,6-trien-10-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

217.14667 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.153946 156.6
[M+Na]+ 240.135888 164.6
[M-H]- 216.139394 158.2
[M+NH4]+ 235.180493 175.8
[M+K]+ 256.109828 160.8
[M+H-H2O]+ 200.143930 156.5
[M+HCOO]- 262.144871 167.2
[M+CH3COO]- 276.160521 166.0
[M+Na-2H]- 238.121336 165.7
[M]+ 217.14612142 155.3
[M]- 217.14721858 155.3
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

No patent data available for this compound.