CID 60222

108132-36-1

Structural Information

Molecular Formula
C18H21NO
SMILES
CN(CCC1=CC=CC=C1)C2=CC3=C(C=C2)OCCC3
InChI
InChI=1S/C18H21NO/c1-19(12-11-15-6-3-2-4-7-15)17-9-10-18-16(14-17)8-5-13-20-18/h2-4,6-7,9-10,14H,5,8,11-13H2,1H3
InChIKey
GHZVQKJIMOYPOZ-UHFFFAOYSA-N
Compound name
N-methyl-N-(2-phenylethyl)-3,4-dihydro-2H-chromen-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

267.16232 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.16960 164.0
[M+Na]+ 290.15154 178.6
[M+NH4]+ 285.19614 174.3
[M+K]+ 306.12548 169.5
[M-H]- 266.15504 172.3
[M+Na-2H]- 288.13699 173.1
[M]+ 267.16177 168.6
[M]- 267.16287 168.6
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

No patent data available for this compound.