CID 1219

74938-11-7

Structural Information

Molecular Formula
C16H25NO
SMILES
CCCN(CCC)C1CCC2=C(C1)C=C(C=C2)O
InChI
InChI=1S/C16H25NO/c1-3-9-17(10-4-2)15-7-5-13-6-8-16(18)12-14(13)11-15/h6,8,12,15,18H,3-5,7,9-11H2,1-2H3
InChIKey
BLYMJBIZMIGWFK-UHFFFAOYSA-N
Compound name
7-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

426
References

561
Patents

247.19362 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.20090 160.1
[M+Na]+ 270.18284 171.5
[M+NH4]+ 265.22744 169.3
[M+K]+ 286.15678 163.7
[M-H]- 246.18634 163.8
[M+Na-2H]- 268.16829 165.3
[M]+ 247.19307 162.7
[M]- 247.19417 162.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe