CID 95604

2677-29-4

Structural Information

Molecular Formula
C10H13Cl
SMILES
C1C=CC2C1C3CC2C(C3)Cl
InChI
InChI=1S/C10H13Cl/c11-10-5-6-4-9(10)8-3-1-2-7(6)8/h1,3,6-10H,2,4-5H2
InChIKey
BVIVIHDQFQUFSV-UHFFFAOYSA-N
Compound name
9-chlorotricyclo[5.2.1.02,6]dec-3-ene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

168.07057 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.07785 142.7
[M+Na]+ 191.05979 152.2
[M-H]- 167.06329 146.7
[M+NH4]+ 186.10439 172.0
[M+K]+ 207.03373 147.6
[M+H-H2O]+ 151.06783 139.7
[M+HCOO]- 213.06877 159.5
[M+CH3COO]- 227.08442 156.6
[M+Na-2H]- 189.04524 144.1
[M]+ 168.07002 142.9
[M]- 168.07112 142.9
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.