CID 14239230

5-(prop-2-en-1-yloxy)-1h-indole

Structural Information

Molecular Formula
C11H11NO
SMILES
C=CCOC1=CC2=C(C=C1)NC=C2
InChI
InChI=1S/C11H11NO/c1-2-7-13-10-3-4-11-9(8-10)5-6-12-11/h2-6,8,12H,1,7H2
InChIKey
CJOAAJIGYICLNT-UHFFFAOYSA-N
Compound name
5-prop-2-enoxy-1H-indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

50
Patents

173.08406 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.09134 135.0
[M+Na]+ 196.07328 144.9
[M-H]- 172.07678 137.3
[M+NH4]+ 191.11788 156.5
[M+K]+ 212.04722 140.5
[M+H-H2O]+ 156.08132 129.0
[M+HCOO]- 218.08226 158.7
[M+CH3COO]- 232.09791 176.8
[M+Na-2H]- 194.05873 142.7
[M]+ 173.08351 136.4
[M]- 173.08461 136.4
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

patents stripe