CID 58224

9-(bis(2-chloroethyl)amino)camphor hydrochloride

Structural Information

Molecular Formula
C14H23Cl2NO
SMILES
CC12CCC(C1(C)CN(CCCl)CCCl)CC2=O
InChI
InChI=1S/C14H23Cl2NO/c1-13-4-3-11(9-12(13)18)14(13,2)10-17(7-5-15)8-6-16/h11H,3-10H2,1-2H3
InChIKey
RRPZILFAYUFLMF-UHFFFAOYSA-N
Compound name
7-[bis(2-chloroethyl)aminomethyl]-1,7-dimethylbicyclo[2.2.1]heptan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

291.11566 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.12294 163.5
[M+Na]+ 314.10488 172.2
[M+NH4]+ 309.14948 175.2
[M+K]+ 330.07882 164.5
[M-H]- 290.10838 164.1
[M+Na-2H]- 312.09033 167.2
[M]+ 291.11511 165.5
[M]- 291.11621 165.5
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.