CID 15975

Brn 0401484

Structural Information

Molecular Formula
C14H18N2O
SMILES
C1CC(NC1)CCC2=CNC3=C2C=C(C=C3)O
InChI
InChI=1S/C14H18N2O/c17-12-5-6-14-13(8-12)10(9-16-14)3-4-11-2-1-7-15-11/h5-6,8-9,11,15-17H,1-4,7H2
InChIKey
ZNEOUBABYGEJBI-UHFFFAOYSA-N
Compound name
3-(2-pyrrolidin-2-ylethyl)-1H-indol-5-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

230.1419 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.14918 152.6
[M+Na]+ 253.13112 159.9
[M-H]- 229.13462 153.9
[M+NH4]+ 248.17572 170.5
[M+K]+ 269.10506 153.8
[M+H-H2O]+ 213.13916 145.6
[M+HCOO]- 275.14010 170.1
[M+CH3COO]- 289.15575 163.5
[M+Na-2H]- 251.11657 154.5
[M]+ 230.14135 148.6
[M]- 230.14245 148.6
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.