CID 377645

9-hydroxyjulolidine

Structural Information

Molecular Formula
C12H15NO
SMILES
C1CC2=CC(=CC3=C2N(C1)CCC3)O
InChI
InChI=1S/C12H15NO/c14-11-7-9-3-1-5-13-6-2-4-10(8-11)12(9)13/h7-8,14H,1-6H2
InChIKey
WOHOVDCGGWSZAN-UHFFFAOYSA-N
Compound name
1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

189.11537 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.12265 140.5
[M+Na]+ 212.10459 146.7
[M-H]- 188.10809 141.7
[M+NH4]+ 207.14919 160.4
[M+K]+ 228.07853 142.8
[M+H-H2O]+ 172.11263 133.6
[M+HCOO]- 234.11357 155.4
[M+CH3COO]- 248.12922 151.9
[M+Na-2H]- 210.09004 148.0
[M]+ 189.11482 135.9
[M]- 189.11592 135.9
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