CID 6434765

63918-61-6

Structural Information

Molecular Formula
C16H16O
SMILES
C1CC2=C(C=C1)/C=C\C(C3=CC=CC=C3C2)O
InChI
InChI=1S/C16H16O/c17-16-10-9-12-5-1-2-6-13(12)11-14-7-3-4-8-15(14)16/h1,3-5,7-10,16-17H,2,6,11H2/b10-9-
InChIKey
NNRDTDHBXOGJDV-KTKRTIGZSA-N
Compound name
(10Z)-tricyclo[10.4.0.03,8]hexadeca-1(12),3,5,7,10,13-hexaen-9-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.12012 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.12740 155.8
[M+Na]+ 247.10934 160.5
[M+NH4]+ 242.15394 159.2
[M+K]+ 263.08328 158.4
[M-H]- 223.11284 157.2
[M+Na-2H]- 245.09479 158.9
[M]+ 224.11957 156.9
[M]- 224.12067 156.9
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

No patent data available for this compound.