CID 34208

Brn 1653825

Structural Information

Molecular Formula
C18H21NO
SMILES
C1CC2=CC=CC=C2CN(CC3=CC=CC=C31)CCO
InChI
InChI=1S/C18H21NO/c20-12-11-19-13-17-7-3-1-5-15(17)9-10-16-6-2-4-8-18(16)14-19/h1-8,20H,9-14H2
InChIKey
RHSFACGWDHFCDY-UHFFFAOYSA-N
Compound name
2-(5,7,12,13-tetrahydrobenzo[d][2]benzazonin-6-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

267.16232 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.16960 187.4
[M+Na]+ 290.15154 189.4
[M+NH4]+ 285.19614 188.7
[M+K]+ 306.12548 187.0
[M-H]- 266.15504 187.9
[M+Na-2H]- 288.13699 187.1
[M]+ 267.16177 187.9
[M]- 267.16287 187.9
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.