CID 27700

5h-dibenzo(a,d)cyclohepten-10-ol, 10,11-dihydro-11-amino-, (z)-

Structural Information

Molecular Formula
C15H15NO
SMILES
C1C2=CC=CC=C2[C@@H]([C@@H](C3=CC=CC=C31)O)N
InChI
InChI=1S/C15H15NO/c16-14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)15(14)17/h1-8,14-15,17H,9,16H2/t14-,15+/m0/s1
InChIKey
LHXJSFVOWHJWNC-LSDHHAIUSA-N
Compound name
(9R,10S)-10-aminotricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaen-9-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

225.11537 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.12265 147.6
[M+Na]+ 248.10459 154.6
[M-H]- 224.10809 152.9
[M+NH4]+ 243.14919 166.2
[M+K]+ 264.07853 154.1
[M+H-H2O]+ 208.11263 143.4
[M+HCOO]- 270.11357 167.2
[M+CH3COO]- 284.12922 159.6
[M+Na-2H]- 246.09004 154.5
[M]+ 225.11482 142.2
[M]- 225.11592 142.2
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.