CID 88465

4-(phenylmethoxy)-1h-indole

Structural Information

Molecular Formula
C15H13NO
SMILES
C1=CC=C(C=C1)COC2=CC=CC3=C2C=CN3
InChI
InChI=1S/C15H13NO/c1-2-5-12(6-3-1)11-17-15-8-4-7-14-13(15)9-10-16-14/h1-10,16H,11H2
InChIKey
LJFVSIDBFJPKLD-UHFFFAOYSA-N
Compound name
4-phenylmethoxy-1H-indole
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

667
Patents

223.09972 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.10700 147.8
[M+Na]+ 246.08894 156.9
[M-H]- 222.09244 153.2
[M+NH4]+ 241.13354 166.7
[M+K]+ 262.06288 151.4
[M+H-H2O]+ 206.09698 140.3
[M+HCOO]- 268.09792 171.3
[M+CH3COO]- 282.11357 160.9
[M+Na-2H]- 244.07439 155.5
[M]+ 223.09917 148.7
[M]- 223.10027 148.7
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.