CID 155858390

2580102-09-4

Structural Information

Molecular Formula
C10H14ClNO
SMILES
C1C[C@H]2C[C@@H]1[C@H]3[C@@H]2CN(C3)C(=O)Cl
InChI
InChI=1S/C10H14ClNO/c11-10(13)12-4-8-6-1-2-7(3-6)9(8)5-12/h6-9H,1-5H2/t6-,7+,8+,9-
InChIKey
AKULMZVZLLRXFX-OJOKCITNSA-N
Compound name
(1R,2S,6R,7S)-4-azatricyclo[5.2.1.02,6]decane-4-carbonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

199.07639 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.08367 141.5
[M+Na]+ 222.06561 150.0
[M+NH4]+ 217.11021 151.5
[M+K]+ 238.03955 149.3
[M-H]- 198.06911 141.3
[M+Na-2H]- 220.05106 141.2
[M]+ 199.07584 142.6
[M]- 199.07694 142.6
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.