CID 300285

20824-61-7

Structural Information

Molecular Formula
C10H13NO
SMILES
C1CC23CC=CCC2(C1)NC3=O
InChI
InChI=1S/C10H13NO/c12-8-9-4-1-2-6-10(9,11-8)7-3-5-9/h1-2H,3-7H2,(H,11,12)
InChIKey
OFEBPXIGIMLSQQ-UHFFFAOYSA-N
Compound name
10-azatricyclo[4.3.2.01,6]undec-3-en-11-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

163.09972 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.10700 133.9
[M+Na]+ 186.08894 140.1
[M-H]- 162.09244 138.1
[M+NH4]+ 181.13354 152.6
[M+K]+ 202.06288 139.5
[M+H-H2O]+ 146.09698 124.4
[M+HCOO]- 208.09792 151.3
[M+CH3COO]- 222.11357 176.6
[M+Na-2H]- 184.07439 140.4
[M]+ 163.09917 137.3
[M]- 163.10027 137.3
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.