CID 30889

Di-tert-butylamine

Structural Information

Molecular Formula
C8H19N
SMILES
CC(C)(C)NC(C)(C)C
InChI
InChI=1S/C8H19N/c1-7(2,3)9-8(4,5)6/h9H,1-6H3
InChIKey
CATWEXRJGNBIJD-UHFFFAOYSA-N
Compound name
N-tert-butyl-2-methylpropan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

13177
Patents

129.15175 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.15903 131.4
[M+Na]+ 152.14097 138.1
[M-H]- 128.14447 132.2
[M+NH4]+ 147.18557 154.0
[M+K]+ 168.11491 138.2
[M+H-H2O]+ 112.14901 127.9
[M+HCOO]- 174.14995 152.6
[M+CH3COO]- 188.16560 177.5
[M+Na-2H]- 150.12642 139.1
[M]+ 129.15120 131.6
[M]- 129.15230 131.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe