CID 3065052

106487-34-7

Structural Information

Molecular Formula
C16H22N2O2
SMILES
CCCN1CCCC(C1)C2=C3CC(=O)NC3=C(C=C2)O
InChI
InChI=1S/C16H22N2O2/c1-2-7-18-8-3-4-11(10-18)12-5-6-14(19)16-13(12)9-15(20)17-16/h5-6,11,19H,2-4,7-10H2,1H3,(H,17,20)
InChIKey
OAUCKFBJGQUGBF-UHFFFAOYSA-N
Compound name
7-hydroxy-4-(1-propylpiperidin-3-yl)-1,3-dihydroindol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

274.16812 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.17540 166.9
[M+Na]+ 297.15734 172.8
[M-H]- 273.16084 168.5
[M+NH4]+ 292.20194 181.9
[M+K]+ 313.13128 167.2
[M+H-H2O]+ 257.16538 159.0
[M+HCOO]- 319.16632 180.3
[M+CH3COO]- 333.18197 195.3
[M+Na-2H]- 295.14279 166.4
[M]+ 274.16757 161.6
[M]- 274.16867 161.6
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

patents stripe