CID 133065594

Ethylamine, n,n-dimethyl-2-(2-methyl-1,2-dicarbaundecaboran(11)-1-yl)-

Structural Information

Molecular Formula
C7H14B9N
SMILES
[B]1[B][B][B]B2[B]C(C2CCN(C)C)([B][B][B]1)C
InChI
InChI=1S/C7H14B9N/c1-7-6(4-5-17(2)3)16(9-7)15-14-13-12-11-10-8-7/h6H,4-5H2,1-3H3
InChIKey
LVAQYSDSQUWSGV-UHFFFAOYSA-N
Compound name
None
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.19637 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.203646 167.1
[M+Na]+ 234.185588 167.6
[M-H]- 210.189094 156.8
[M+NH4]+ 229.230193 182.2
[M+K]+ 250.159528 171.6
[M+H-H2O]+ 194.193630 163.8
[M+HCOO]- 256.194571 174.9
[M+CH3COO]- 270.210221 198.8
[M+Na-2H]- 232.171036 173.6
[M]+ 211.19582142 173.4
[M]- 211.19691858 173.4
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.